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COC(=O)c1ccc(C(=O)C(Br)c2ccccc2)cc1

ir: 7 9 7 4 12 7 2 3 10 13 21 12 6 6 12 7 10 10 7 7 12 24 12 7 14 25 17 17 8 11 22 16 13 10 4 12 8 16 41 29 23 22 12 7 7 4 3 1 4 3 4 4 16 12 10 11 34 22 16 3 3 2 2 1 2 3 2 2 7 16 21 5 5 2 3 6 3 6 4 6 11 3 1 1 2 3 4 4 8 8 2 2 2 2 1 2 3 3 2 2 2 2 3 2 3 3 5 4 5 24 15 9 4 6 11 33 11 6 9 11 11 9 8 14 14 12 12 9 9 6 2 2 3 6 7 28 9 7 5 19 17 23 18 74 78 12 7 17 9 4 11 8 14 4 2 4 2 1 2 4 2 0 1 3 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 2 1 1 2 3 2 3 4 7 6 6 14 14 12 58 100 94 30 7 5 5 6 4 3 3 4 1 1 2 2 1 1 1 2 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 80 80 m 2H | 80 79 m 2H | 75 74 m 2H | 74 74 m 2H | 73 73 m 1H | 62 62 d 1H J 9 | 39 39 s 2H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CSc1c(CCO)[nH]c2ccc(Cl)cc12

ir: 6 6 12 10 5 16 9 7 11 15 4 6 1 11 5 3 4 2 8 3 2 4 4 2 5 4 3 5 8 14 39 15 12 4 13 37 7 0 3 2 2 1 1 3 2 4 4 2 3 1 2 3 3 32 29 2 2 2 5 2 2 5 4 6 5 14 24 24 3 3 11 5 2 0 3 4 3 4 4 3 5 6 6 5 6 7 11 12 34 84 100 38 48 29 8 11 10 3 2 5 23 4 0 11 12 8 8 83 20 3 10 5 9 4 7 20 23 11 14 4 2 2 2 1 3 4 1 3 1 1 2 1 0 0 1 1 1 1 1 3 2 1 1 3 22 1 3 5 0 1 1 2 3 1 22 19 3 2 1 0 0 1 4 3 1 0 0 1 0 0 1 1 0 0 0 1 1 1 0 0 0 0 0 1 0 0 0 1 0 1 0 0 0 0 0 0 1 0 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 1 1 1 0 0 1 1 0 0 0 0 0 0 1 1 1 1 1 1 1 1 1 1 0 0 0 0 0 1 0 1 1 0 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 3 1 1 2 4 2 4 2 7 3 3 1 5 4 7 13 11 17 55 32 17 11 12 9 10 7 22 11 7 5 8 3 1 2 3 1 2 4 3 1 3 2 7 11 40 40 33 6 6 4 3 2 1 2 1 1 0 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 88 87 s 1H | 76 75 d 1H J 27 | 73 73 d 1H J 73 | 72 72 dd 1H J 25 72 | 39 39 dt 2H J 46 59 | 39 38 dd 1H J 54 62 | 29 29 t 2H J 46 | 25 25 s 3H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COC(=O)C(=Cc1ccc(OC)c(OC)c1)NC(C)=O

ir: 21 6 6 6 7 5 4 9 7 10 10 10 4 10 21 29 52 14 17 10 13 18 6 10 7 6 6 6 4 10 4 6 8 8 9 10 6 11 16 7 19 23 15 22 18 15 10 5 6 13 5 3 18 42 58 19 18 13 4 4 13 20 12 26 20 14 12 11 12 43 31 13 13 9 5 6 5 7 6 1 3 4 2 2 5 6 17 8 5 15 4 3 15 3 2 2 4 3 2 9 7 4 14 4 7 12 8 2 4 3 2 2 10 15 4 3 11 14 15 33 28 21 5 21 11 11 7 8 5 4 3 3 4 2 1 3 3 2 2 4 18 78 66 97 56 44 14 10 56 24 7 20 12 14 8 8 12 4 10 4 3 2 2 3 7 2 2 2 2 2 2 3 1 0 2 3 1 1 2 3 1 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 2 0 1 2 2 0 1 3 2 0 1 3 1 0 1 3 1 0 1 3 1 0 2 3 1 0 2 2 1 0 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 3 3 0 1 4 8 2 2 6 3 2 3 4 4 1 3 10 7 9 22 34 63 85 99 7 7 8 3 4 3 2 2 3 4 4 3 3 2 3 3 6 2 16 17 11 13 100 71 7 6 7 4 3 2 2 3 2 1 1 1 2 1 1 2 2 1 1 2 1 1 1 2 1 1 2 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2; 1HNMR: 76 76 s 1H | 72 72 s 1H | 71 70 dd 1H J 19 89 | 69 69 m 2H | 39 38 d 7H J 77 | 38 38 s 3H | 21 21 s 3H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

C[C@@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@]2(C)[C@H]1C(=O)CO

ir: 1 1 1 1 1 1 1 1 1 1 1 1 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 0 1 1 1 1 1 1 2 5 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 2 6 1 1 1 1 1 1 4 7 12 10 5 4 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 0 1 1 4 0 9 1 1 1 1 1 1 0 0 1 2 1 0 0 1 0 0 1 1 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 2 4 4 3 1 1 1 1 1 2 2 100 4 1 1 1 1 1 1 1 0 1 1 1 0 1 0 0 1 1 0 1 1 0 0 0 0 1 1 0 0 1 0 1 1 1 1 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 72 71 ddq 1H J 10 19 106 | 63 63 q 1H J 15 | 62 62 dd 1H J 14 107 | 55 54 dddd 0H J 17 25 40 64 | 54 53 m 0H | 44 43 tdt 1H J 39 50 66 | 43 42 dd 1H J 54 133 | 42 41 dd 1H J 54 133 | 36 35 t 1H J 53 | 28 27 d 1H J 49 | 24 23 dt 1H J 15 71 | 22 20 m 2H | 20 19 dd 1H J 41 135 | 19 18 m 1H | 18 18 m 1H | 17 16 m 2H | 16 15 m 1H | 15 14 dddd 1H J 18 39 81 130 | 13 12 t 3H J 12 | 12 11 ddp 1H J 16 65 112 | 9 9 m 6H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

O=C(CBr)c1ccncc1Br

ir: 4 4 7 3 2 3 3 2 1 3 2 2 2 10 7 13 14 17 17 10 15 14 12 31 100 71 42 13 5 6 4 4 11 13 16 9 6 8 13 10 22 30 19 22 12 15 15 2 3 4 2 1 2 5 5 3 2 3 1 1 2 3 1 0 2 4 8 0 5 4 3 6 30 27 29 15 5 4 2 2 3 4 6 2 3 4 4 5 20 5 14 1 2 3 2 2 13 17 9 10 5 3 2 5 6 22 14 14 11 9 11 41 63 13 15 7 22 7 15 11 12 31 18 46 22 10 5 12 7 7 5 6 32 27 26 14 10 13 7 10 6 3 7 13 61 25 54 8 5 3 3 4 6 6 6 3 2 2 22 25 25 6 2 2 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 3 4 7 5 6 7 6 3 4 4 5 7 17 31 26 27 55 17 2 2 4 6 2 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 0 1 2; 1HNMR: 89 89 d 1H J 13 | 87 86 dd 1H J 13 49 | 77 76 d 1H J 49 | 44 44 s 2H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CC(C)c1cccc(Nc2ncc(C(F)(F)F)c(Cl)n2)c1

ir: 1 1 7 3 1 2 1 1 1 1 1 1 1 1 0 2 2 6 14 2 2 2 33 2 1 1 1 2 1 1 1 4 2 4 1 1 1 1 1 10 1 1 1 1 1 0 1 2 6 1 2 2 2 1 14 25 100 8 2 2 2 2 1 0 1 2 1 13 3 2 1 1 1 2 1 0 1 1 1 1 1 2 1 1 1 1 1 4 2 1 1 6 1 5 1 1 1 1 5 9 8 1 2 1 3 10 2 1 1 1 1 1 1 1 1 1 1 1 2 1 2 1 1 3 2 2 1 1 3 3 1 3 2 1 0 1 1 0 0 1 2 12 25 6 70 4 2 1 2 53 4 4 3 23 2 1 3 15 43 3 1 1 2 28 8 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 2 2 3 2 4 9 10 3 1 2 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 0 1 1 2 4 18 73 13 5 0 1 1 1 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 89 89 s 1H | 87 87 q 1H J 24 | 75 74 ddd 1H J 12 21 77 | 73 72 d 1H J 77 | 72 72 m 1H | 70 70 ddt 1H J 9 20 77 | 29 28 m 1H | 13 12 d 6H J 66

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

Cc1sc(-c2ccc(C(=O)O)cc2)nc1OCC(=O)NCCC(C)C

ir: 6 4 25 17 19 11 22 48 2 8 14 8 31 7 36 11 29 16 4 8 19 5 4 7 2 2 3 1 1 3 3 0 2 5 3 8 10 11 6 2 2 4 4 3 2 5 3 0 2 4 9 20 7 8 10 58 15 5 8 16 8 15 51 3 5 17 3 5 13 4 5 8 9 5 1 1 8 2 12 2 18 19 7 3 6 22 7 3 4 19 2 2 2 3 2 7 7 5 2 9 5 4 2 8 20 33 12 21 13 13 26 13 11 8 3 8 7 10 9 28 17 18 53 17 5 7 14 8 8 11 7 31 9 5 9 5 4 2 2 5 4 9 19 33 21 33 14 26 6 3 2 26 2 3 3 3 2 9 1 2 1 0 1 2 1 0 1 3 2 0 1 2 1 1 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 1 1 2 0 0 1 1 1 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 2 1 3 1 1 2 2 2 2 2 3 7 7 5 11 19 16 6 3 7 4 16 16 14 63 78 30 34 100 26 7 10 1 3 2 3 18 24 2 2 1 1 3 1 3 3 3 3 9 3 8 16 7 37 10 2 1 2 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 1 1 1 1 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 80 80 m 2H | 78 77 m 2H | 66 65 t 1H J 50 | 47 47 s 2H | 32 31 td 2H J 49 60 | 23 23 s 2H | 17 16 dp 1H J 67 133 | 15 14 q 2H J 62 | 10 9 d 6H J 66

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

Cn1c(Nc2nc3ccc(OC(F)(F)F)cc3s2)nc2cc(C(=O)NCC(F)(F)F)ccc21

ir: 3 4 4 4 4 3 3 3 7 2 5 4 2 3 10 9 16 11 9 27 5 13 31 21 24 11 33 12 13 8 19 23 3 2 6 23 5 13 21 20 43 5 8 4 3 5 6 6 4 2 3 1 1 3 11 26 18 8 2 2 8 3 1 1 1 2 2 10 9 4 6 3 1 3 1 1 1 1 1 1 2 5 7 3 2 1 3 3 4 3 8 4 3 3 3 2 12 8 6 17 38 18 18 6 3 7 4 2 3 10 30 7 4 6 2 7 5 5 7 7 11 13 6 9 21 61 14 8 7 2 1 7 2 1 1 2 2 1 0 8 46 4 2 11 10 4 7 100 15 4 16 0 21 39 64 8 69 3 2 3 2 2 3 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 0 1 1 1 0 1 1 0 1 1 1 0 1 1 2 0 1 2 2 1 1 1 2 1 2 3 6 5 8 6 21 36 29 8 4 4 2 4 2 1 1 2 1 1 1 2 2 1 6 7 3 8 8 19 15 23 19 34 36 9 3 9 4 2 2 2 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 80 80 d 1H J 22 | 80 79 ddt 1H J 22 55 77 | 79 78 m 2H | 76 75 d 1H J 68 | 73 73 m 2H | 66 66 s 1H | 42 40 qd 2H J 55 130 | 38 37 s 3H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CCOc1c(Cl)cc2cc(CC)oc2c1C(=O)OC

ir: 34 39 45 42 32 28 19 32 15 8 11 13 17 7 5 10 12 5 8 6 8 3 1 6 6 3 5 8 7 5 10 26 13 5 3 8 8 8 8 16 26 39 19 12 22 29 8 8 10 10 11 11 8 0 13 13 6 13 9 12 3 2 9 18 29 80 100 20 8 7 11 20 13 9 14 56 18 3 6 9 32 30 9 4 2 2 5 5 3 3 8 10 6 14 63 41 19 21 14 7 7 5 4 37 48 5 7 4 1 5 10 17 18 12 21 20 10 56 19 15 8 10 11 9 10 11 23 11 12 7 10 8 7 6 17 21 14 6 13 21 94 74 52 30 14 10 19 33 35 31 87 57 18 43 81 34 10 7 5 3 3 11 4 1 3 6 3 1 3 5 3 0 3 5 3 2 4 6 3 1 3 5 2 1 3 4 2 1 4 5 2 1 4 4 2 1 4 4 2 2 4 4 2 2 4 4 2 2 4 4 1 2 4 3 1 2 5 3 1 3 5 3 1 3 5 3 1 3 5 3 1 3 5 3 1 3 5 2 1 3 5 2 1 3 4 2 2 4 5 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 4 2 3 5 7 6 8 8 7 4 6 8 11 8 8 10 8 10 11 23 30 12 20 26 80 49 23 32 20 17 6 8 4 2 4 5 3 2 4 4 3 3 4 4 3 3 4 4 2 2 4 4 2 2 4 4 2 2 4 3 2 2 4 3 1 2 4 3 1 2 4 3 1 3 4 3 1 3 4 3 1 3 4 3 1 3 4 2 1 3 4 2 1 3 4 2 2 3 4 2 2 3 4 2 2 4 4 2 2 4 3 2 2 4 3 2 2 4 3 2 2 4 3 1 2 4 3 1 3 4 3 1 3 4 3 1; 1HNMR: 76 76 d 1H J 22 | 67 66 dt 1H J 9 20 | 42 42 q 2H J 62 | 39 39 s 2H | 29 28 qd 2H J 9 73 | 15 14 t 3H J 62 | 13 13 t 3H J 73

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COc1ccc(SCCc2ccccc2)cc1

ir: 1 1 1 1 1 1 1 2 3 3 4 5 7 5 1 1 1 1 1 1 1 1 1 5 3 1 1 1 1 7 5 4 4 4 3 4 5 16 6 43 34 9 8 5 4 1 1 4 1 1 2 10 20 36 81 8 8 6 2 4 5 7 7 8 4 6 3 1 7 11 2 1 2 1 1 1 2 4 3 2 2 2 4 2 2 2 5 15 5 6 3 2 2 2 1 2 3 10 6 3 3 1 1 1 3 5 6 1 2 2 1 1 1 1 1 2 5 5 3 3 2 3 1 3 6 3 2 3 1 3 2 2 2 5 13 20 4 3 1 1 1 6 17 22 16 26 50 11 5 5 5 15 21 6 3 2 2 1 1 3 4 3 1 1 1 0 1 1 1 0 0 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 1 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 1 1 1 1 1 1 1 1 1 1 2 4 2 2 2 2 3 3 6 12 18 15 41 100 41 17 17 6 11 8 5 1 2 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 0 1 0 0 0 1; 1HNMR: 74 73 m 2H | 73 72 m 3H | 72 71 ddq 2H J 9 15 66 | 69 68 m 2H | 38 38 s 2H | 31 30 t 2H J 61 | 29 28 td 2H J 9 60

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COC(=O)Cc1ccccc1Oc1ccc(C=O)cc1C

ir: 2 2 1 2 2 2 1 1 1 2 2 0 1 1 0 0 0 1 1 1 1 2 1 1 2 1 4 3 2 1 1 0 1 2 1 1 2 9 1 3 4 7 5 4 17 7 2 1 1 1 1 1 2 6 17 25 2 2 1 1 1 1 1 7 2 0 1 1 1 2 2 1 1 0 4 1 1 1 1 1 1 1 1 1 1 1 8 2 1 7 7 1 1 1 1 1 3 4 5 7 3 3 2 1 8 5 1 1 1 1 0 0 0 1 1 2 1 2 2 4 2 1 1 6 5 2 3 3 1 5 2 1 1 1 1 1 2 21 2 1 1 5 7 29 24 10 2 14 15 2 1 2 1 1 0 1 1 0 1 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 2 0 1 1 1 1 3 1 1 1 1 2 2 4 4 9 18 100 11 7 9 3 1 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 99 99 s 1H | 78 77 m 2H | 74 73 m 2H | 72 71 td 1H J 13 77 | 70 70 d 1H J 86 | 69 69 dd 1H J 12 79 | 37 36 s 3H | 36 36 d 2H J 7 | 22 22 s 3H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

Cc1[nH]c2ccccc2c1CCN

ir: 2 3 4 1 1 2 2 2 8 8 0 1 1 1 1 1 2 1 1 2 2 1 1 2 3 4 15 13 19 5 2 2 1 3 6 10 6 2 2 1 2 26 20 2 5 1 3 1 3 3 5 4 9 15 100 73 84 1 3 5 3 1 5 3 2 2 14 40 37 58 42 10 4 4 6 4 2 3 2 2 2 6 8 3 3 2 2 1 2 3 2 2 1 2 4 3 4 3 4 7 5 2 2 3 2 2 8 10 14 5 2 2 1 2 2 2 3 2 3 3 2 4 3 11 9 4 8 11 6 4 9 4 7 25 39 39 6 10 3 4 3 2 3 3 4 3 5 3 3 2 2 0 2 16 19 2 3 0 1 2 5 4 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 2 1 2 2 2 2 2 1 2 2 6 6 5 6 13 10 9 8 2 2 3 3 2 2 3 2 2 9 17 44 30 22 9 12 4 3 31 45 45 11 10 14 20 12 5 4 3 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 74 73 m 1H | 72 72 d 2H J 66 | 72 71 m 2H | 33 32 t 2H J 50 | 32 31 tt 2H J 48 65 | 23 23 s 2H | 20 19 t 2H J 65

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CC1(O)CC(=O)OC(CCc2ccc(OCc3ccccc3)cc2)C1

ir: 2 1 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 4 9 2 2 1 1 1 1 1 1 1 1 2 3 2 3 3 2 3 3 3 1 1 1 4 2 3 1 1 2 6 1 0 1 1 1 1 4 12 35 6 1 0 1 1 1 1 2 3 2 1 1 3 2 5 3 1 1 2 1 3 3 2 0 2 2 2 3 2 1 1 1 1 1 1 1 1 1 1 1 3 4 7 4 3 3 3 2 1 1 2 3 1 1 2 2 5 4 1 1 1 1 1 2 4 26 10 5 3 6 3 1 1 4 2 1 1 1 1 1 0 1 1 1 0 0 1 0 0 0 1 1 0 1 1 1 1 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 1 1 1 2 4 5 6 3 15 8 2 2 2 1 0 9 100 22 9 2 0 1 1 1 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 0 0 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 74 73 m 4H | 73 73 m 1H | 70 70 dq 2H J 9 86 | 69 68 m 2H | 51 50 t 2H J 9 | 48 48 tt 1H J 51 59 | 43 42 s 1H | 28 27 dtt 1H J 9 76 143 | 27 26 m 2H | 24 23 d 1H J 176 | 22 21 dd 1H J 59 143 | 21 20 dtd 1H J 50 77 143 | 20 19 dd 1H J 58 142 | 19 18 dtd 1H J 51 77 143 | 13 13 s 2H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COC(=O)C1CCCCC1(O)C(=O)c1ccccc1

ir: 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4 6 8 3 1 1 1 1 0 2 1 1 1 1 2 1 1 1 3 8 3 2 1 1 1 1 1 1 2 1 1 1 1 1 1 1 0 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 1 1 1 1 1 2 3 5 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 2 5 2 1 1 1 3 1 1 1 1 1 2 1 1 2 3 1 1 1 1 4 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 2 8 9 2 4 1 1 1 1 1 1 1 1 1 1 1 0 0 0 1 1 1 1 0 0 1 1 1 1 1 1 1 0 1 1 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 0 1 1 1 1 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 0 1 2 3 0 5 4 1 1 2 3 2 100 32 1 2 2 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 78 78 m 2H | 76 75 tt 1H J 16 76 | 72 72 m 2H | 53 53 s 1H | 36 35 s 2H | 32 31 t 1H J 66 | 22 20 m 2H | 19 16 m 7H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CCCN(CCC)CCCCc1nc2ccc(CCl)cc2n1S(=O)(=O)c1ccc(C)cc1

ir: 2 5 6 5 7 8 6 5 14 5 8 9 2 7 21 29 4 3 9 11 3 4 6 30 2 14 7 2 9 1 1 4 1 3 2 5 1 1 3 2 14 14 9 4 5 4 4 2 1 3 2 8 7 35 3 10 4 3 3 2 3 8 30 4 6 8 12 11 15 30 3 3 11 7 2 1 3 3 4 3 1 6 3 12 58 100 9 10 22 3 3 4 5 17 30 3 3 3 2 2 3 4 4 4 2 3 2 7 2 7 11 10 13 4 3 3 5 5 4 5 12 4 9 8 7 43 8 10 4 2 6 3 2 2 2 2 4 21 7 9 4 7 6 3 4 3 15 12 4 2 2 14 10 1 1 6 2 0 1 2 3 0 1 1 2 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 1 2 1 1 1 1 1 0 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 2 2 1 2 3 3 7 5 3 2 1 4 7 7 11 11 10 47 11 57 16 6 3 2 1 2 1 2 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 78 78 dq 1H J 8 22 | 78 77 m 2H | 75 75 d 1H J 74 | 75 74 ddt 1H J 9 20 75 | 72 72 m 2H | 46 46 t 2H J 9 | 29 28 t 2H J 66 | 25 24 dt 6H J 62 169 | 24 24 d 2H J 9 | 18 17 p 2H J 69 | 17 15 m 6H | 9 9 t 6H J 79

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

N#Cc1ccc([C@@H]2CC[C@@H](CCCC=O)CC2)cc1

ir: 0 1 1 1 0 1 1 0 0 1 1 1 1 0 1 2 1 1 1 1 0 4 2 1 1 6 27 8 2 1 2 2 1 3 1 2 4 6 12 1 1 2 1 0 1 0 1 2 2 2 2 2 3 4 5 16 7 7 3 1 3 1 1 2 1 1 2 4 4 2 3 2 1 1 1 1 1 0 0 1 0 1 0 0 0 1 1 1 2 0 0 1 1 2 2 5 3 3 1 2 3 2 4 3 2 2 2 3 4 4 4 5 5 2 5 3 4 3 4 3 1 2 5 2 2 6 3 2 1 2 1 2 0 1 3 3 1 0 1 1 1 1 2 1 1 7 49 30 5 6 2 2 5 2 0 2 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 1 1 1 2 3 1 2 1 3 2 1 4 3 12 10 10 20 100 14 4 2 4 4 1 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 97 96 tt 1H J 9 57 | 76 75 m 2H | 73 73 m 2H | 26 25 tdd 1H J 38 46 74 | 24 22 m 2H | 18 17 m 2H | 16 14 m 9H | 13 12 m 3H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

C=CCCCc1ccc(-c2ccc(Br)cc2)nc1

ir: 0 2 6 4 3 3 1 1 1 1 1 2 2 4 3 5 3 1 1 1 1 0 1 2 2 3 3 3 2 3 2 3 4 3 7 22 34 20 5 2 1 3 2 1 1 2 1 6 2 4 12 13 46 26 14 7 11 5 3 2 2 0 2 1 1 2 2 5 8 9 13 12 9 2 3 2 2 2 1 1 1 1 1 1 9 2 4 2 3 8 2 2 3 2 1 1 1 2 0 1 2 5 3 2 1 2 2 2 4 4 0 3 4 1 0 4 8 12 4 6 5 7 4 12 8 7 8 6 2 2 1 1 2 5 8 5 71 37 15 7 3 2 2 2 5 14 42 9 6 10 10 7 4 2 2 1 3 2 4 29 2 1 4 5 3 1 1 1 1 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 1 0 0 1 1 1 0 1 1 0 1 3 2 4 2 2 3 3 7 4 4 9 13 20 46 100 29 19 18 12 5 2 6 5 2 2 1 1 0 0 1 1 0 0 0 1 0 0 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 84 84 dt 1H J 10 19 | 78 78 m 2H | 76 76 m 2H | 76 75 d 1H J 82 | 74 73 ddt 1H J 8 18 81 | 58 56 m 1H | 52 51 m 1H | 50 49 ddt 1H J 13 23 170 | 27 26 tt 2H J 10 98 | 21 20 tdt 2H J 14 67 82 | 18 17 m 2H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CC(C)[C@H]1c2ncc(C(=O)O)cc2CN1Cc1ccc(C(F)(F)F)cc1

ir: 2 4 5 3 6 5 7 3 3 3 3 6 5 7 7 6 5 3 13 10 34 43 52 13 6 7 8 5 4 4 9 16 4 5 7 14 11 2 3 2 1 2 1 2 1 2 2 4 1 2 2 3 5 11 8 6 37 9 2 1 3 13 3 3 2 1 28 1 2 2 5 3 2 2 3 7 16 42 6 25 24 46 16 5 19 3 17 5 5 8 4 2 3 2 1 2 4 2 14 11 15 5 1 1 2 2 0 3 13 3 1 5 61 13 3 23 7 3 5 4 4 2 4 2 8 9 26 7 5 8 11 4 5 5 22 2 2 1 2 2 2 2 1 2 5 40 90 7 9 6 3 3 4 4 4 22 2 1 1 1 1 23 4 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 3 3 5 4 3 7 27 44 11 2 3 3 5 1 3 8 9 100 5 0 2 3 1 0 2 2 1 0 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 88 88 d 1H J 17 | 81 80 p 1H J 10 | 76 76 dq 2H J 15 76 | 74 74 dt 2H J 9 74 | 40 40 m 1H | 39 39 m 2H | 39 38 dt 1H J 10 124 | 37 36 dt 1H J 10 125 | 22 20 m 1H | 10 10 dd 3H J 13 77 | 10 9 dd 3H J 13 77

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CCn1c(CCC(F)(F)c2cccc(Br)c2)nn(Cc2ccc(C(C)(C)C)cc2)c1=O

ir: 7 5 5 5 4 3 4 2 3 3 3 6 3 3 6 3 3 3 2 3 3 2 3 4 5 4 3 6 26 11 7 7 18 4 4 5 6 4 4 7 68 22 6 4 8 3 10 22 24 9 3 4 7 19 22 12 11 6 9 3 7 10 10 3 3 3 4 8 15 5 5 3 6 2 3 4 4 2 5 3 3 2 3 4 3 8 12 4 3 3 5 8 8 8 4 3 3 3 4 4 6 6 5 6 2 2 3 3 4 7 5 3 6 11 5 13 0 15 18 12 11 9 20 23 6 8 24 11 13 5 15 10 6 5 4 10 28 4 3 13 23 3 3 3 3 6 8 39 11 15 19 9 5 4 14 3 19 5 3 3 3 2 3 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 4 4 3 3 5 8 5 6 3 3 3 4 9 20 30 12 19 100 39 17 6 5 4 2 3 3 2 3 3 3 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2; 1HNMR: 76 76 t 1H J 22 | 75 74 dddd 2H J 11 21 77 130 | 74 73 m 3H | 73 72 dt 2H J 9 76 | 52 52 d 2H J 9 | 40 39 q 2H J 76 | 28 27 tt 2H J 23 79 | 26 24 tt 2H J 79 141 | 14 13 m 11H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COc1ccccc1-c1cc2cc(C3=CCN(CCN(C)C(=O)OC(C)(C)C)C3)ccc2[nH]1

ir: 5 9 9 9 25 14 5 6 16 10 24 11 8 6 0 5 7 8 5 20 10 4 7 3 3 3 3 5 14 35 5 3 1 6 9 4 3 12 4 1 5 21 69 37 2 3 9 5 3 1 2 5 5 22 27 1 3 4 6 1 2 5 7 6 8 15 19 16 9 4 2 3 3 4 9 4 5 45 15 2 3 4 3 5 6 2 7 9 8 7 11 8 4 4 3 2 2 8 6 4 24 5 26 30 14 6 2 3 3 4 1 4 6 4 5 5 4 3 8 8 9 12 12 20 23 22 5 18 9 13 25 10 3 2 8 7 6 13 2 4 4 16 9 5 4 2 2 3 2 31 60 100 7 7 5 6 3 12 1 1 1 2 4 8 2 1 1 1 1 1 1 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 1 0 0 0 1 0 0 1 1 1 1 2 2 1 4 2 1 3 1 2 1 2 3 2 2 6 13 37 10 31 44 49 6 15 3 3 2 1 2 2 2 1 1 1 1 0 0 1 1 1 0 1 1 2 5 6 19 44 15 3 2 1 2 1 1 0 0 1 1 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 92 91 s 1H | 78 77 dd 1H J 15 23 | 75 75 dd 1H J 13 75 | 74 73 m 2H | 73 73 dd 1H J 15 73 | 72 71 td 1H J 11 75 | 70 70 dd 1H J 12 77 | 69 69 d 1H J 22 | 63 63 tt 1H J 9 21 | 39 39 s 3H | 38 38 d 2H J 9 | 34 34 m 4H | 29 29 s 3H | 29 28 t 2H J 55 | 15 14 s 8H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CC(=O)Nc1ccc(/C=C/C(=O)NCC(=O)N(C)c2ccc(C)c(CO)c2C)cn1

ir: 3 1 2 2 2 1 0 1 1 1 1 1 2 4 2 5 6 2 1 1 2 1 3 3 7 4 7 9 4 4 5 4 6 8 33 100 23 24 8 4 7 1 3 6 3 1 1 3 4 2 2 3 8 50 33 6 3 1 1 1 2 1 1 2 1 1 1 3 2 1 8 3 2 3 2 2 2 2 2 2 2 13 13 8 2 7 19 10 10 6 3 4 2 1 3 2 2 2 2 5 12 4 3 3 2 1 6 3 2 1 1 1 1 1 8 2 2 1 4 2 2 3 11 2 2 2 3 5 15 10 3 13 2 2 3 2 1 3 2 2 2 5 9 21 10 40 16 55 20 32 7 14 7 6 2 0 1 3 3 28 12 2 2 0 1 2 2 21 1 1 1 0 1 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 1 0 1 1 0 0 0 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 3 1 1 1 1 2 2 2 2 2 2 2 5 6 9 1 7 21 6 4 2 2 1 1 2 14 4 1 1 1 1 0 1 1 2 0 2 3 2 9 13 46 24 7 6 7 2 1 1 1 1 1 1 1 1 0 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0; 1HNMR: 90 89 s 1H | 86 85 d 1H J 18 | 83 83 t 1H J 55 | 81 80 m 1H | 77 76 d 1H J 166 | 75 74 d 1H J 81 | 70 70 dq 1H J 10 82 | 70 69 d 1H J 81 | 67 66 d 1H J 167 | 47 47 d 2H J 53 | 39 39 d 2H J 55 | 35 34 s 3H | 33 33 t 1H J 54 | 23 23 d 3H J 9 | 22 22 s 3H | 22 21 s 3H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COC(=O)c1ccc(C2CCOC2)c(OCC2CC2)n1

ir: 4 2 1 2 7 8 4 6 3 11 90 9 6 4 0 2 2 3 3 4 5 1 9 8 7 4 1 3 4 2 1 3 3 2 6 16 26 3 6 12 85 25 13 4 3 2 3 3 4 9 4 4 6 24 39 8 6 4 5 2 6 5 3 12 5 4 3 8 3 4 30 5 4 24 8 11 5 4 4 2 3 4 26 4 5 13 5 10 15 38 33 11 3 4 7 9 12 2 4 4 1 4 9 3 5 3 3 4 2 4 4 5 4 5 5 16 25 15 26 8 19 7 4 3 3 6 40 37 100 8 5 3 2 2 2 2 2 3 7 4 83 25 10 37 30 26 9 5 28 4 4 4 5 5 7 2 2 2 2 3 6 8 2 1 1 2 1 1 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 1 1 1 2 2 1 1 1 2 1 1 2 1 1 1 2 2 1 4 2 2 1 4 5 3 3 3 7 7 12 9 16 13 7 19 34 29 6 17 9 7 1 2 2 2 1 2 2 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1; 1HNMR: 77 77 d 1H J 85 | 76 76 m 1H | 42 41 d 2H J 54 | 40 39 m 1H | 40 40 s 3H | 39 38 ddd 1H J 28 47 110 | 38 36 m 2H | 32 31 m 1H | 26 26 dddd 1H J 27 45 61 135 | 24 23 m 1H | 15 14 m 1H | 7 7 m 2H | 5 4 m 2H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

c1ccc(Nc2ncnc3[nH]cnc23)cc1

ir: 4 6 7 6 4 9 6 31 10 12 28 6 8 11 10 7 6 12 14 28 54 22 48 39 16 6 13 15 8 11 4 8 4 3 4 5 4 4 5 17 48 9 20 38 5 6 9 7 4 6 8 9 10 15 16 5 4 4 4 3 3 4 4 4 3 5 10 13 13 16 5 4 4 4 4 9 12 13 11 5 10 9 4 4 4 5 25 9 7 21 3 4 7 18 6 4 8 4 5 4 4 8 7 13 18 14 40 7 4 4 4 4 3 4 4 3 3 3 4 7 4 4 11 8 5 5 8 10 32 48 23 6 4 24 5 6 23 8 10 7 6 11 16 8 13 13 6 0 55 100 5 19 17 6 18 14 14 2 3 5 5 18 25 7 6 4 3 5 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 3 3 4 3 3 3 4 3 3 3 3 3 3 4 3 3 3 4 3 3 3 4 3 3 3 4 3 3 3 4 3 3 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 3 3 4 3 3 3 4 3 3 3 4 3 3 3 4 3 3 3 4 3 3 4 4 3 3 4 3 3 3 3 3 3 3 4 3 3 3 4 3 3 3 4 3 3 4 4 3 3 6 7 15 12 17 20 5 3 5 5 4 3 4 6 3 4 4 5 3 3 6 6 6 9 13 27 28 39 93 36 23 28 4 4 4 4 5 4 4 4 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3; 1HNMR: 87 87 s 1H | 83 83 s 1H | 81 80 d 1H J 59 | 76 76 m 2H | 73 73 m 2H | 69 68 tt 1H J 12 69

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CCCC1CCC(=O)c2cn(Cc3ccc(OC)cc3)nc21

ir: 1 1 2 1 2 2 2 2 2 2 3 3 3 1 2 2 2 1 1 1 2 2 1 1 1 2 1 1 1 1 1 1 1 1 2 11 7 6 4 5 2 4 5 10 1 2 2 3 2 5 7 4 3 2 7 4 14 2 5 7 5 3 3 5 2 2 4 9 2 6 1 2 1 1 1 3 2 1 1 1 1 1 1 1 1 1 3 11 4 2 1 1 2 2 4 3 4 3 1 7 2 1 1 2 3 2 3 4 4 1 1 1 2 2 3 3 2 2 4 3 3 7 5 15 5 5 12 9 1 2 3 2 2 2 1 1 1 1 1 1 1 4 13 18 2 2 4 3 54 11 100 17 8 1 1 3 2 1 1 2 1 1 2 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 1 1 1 1 1 1 1 1 1 1 2 1 1 2 2 2 2 2 2 2 3 2 3 6 10 4 11 14 11 10 13 7 6 4 2 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 77 77 t 1H J 9 | 73 73 dp 2H J 9 71 | 69 69 m 2H | 54 53 q 2H J 9 | 38 38 s 2H | 33 32 p 1H J 57 | 29 28 ddd 1H J 70 95 150 | 28 27 ddd 1H J 70 97 150 | 22 21 dddd 1H J 53 70 97 149 | 19 18 m 2H | 16 15 m 2H | 15 14 m 1H | 10 9 t 3H J 74

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COCCCn1cc(C)c2ccc(C(=O)N(C[C@H]3CNC[C@@H]3Cc3ccccc3)C(C)C)cc21

ir: 1 0 0 1 1 1 1 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 1 0 1 0 1 2 4 3 1 0 1 2 6 4 4 6 3 4 3 1 1 2 2 2 0 1 2 2 2 2 1 1 1 2 1 3 3 6 3 4 3 5 13 7 7 4 1 2 4 4 1 1 2 1 0 1 0 0 0 1 1 1 4 2 1 0 0 1 1 1 2 1 2 2 1 5 3 6 3 3 4 4 11 5 4 4 4 1 1 2 3 1 2 1 4 7 4 2 4 3 1 1 1 1 1 1 1 1 7 9 2 1 1 2 1 2 8 4 4 7 5 11 2 1 3 2 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 1 1 1 1 1 1 1 1 6 7 8 5 26 9 4 6 4 1 0 1 1 1 0 0 0 0 1 1 1 3 10 100 6 4 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 80 80 d 1H J 86 | 78 77 dq 2H J 20 40 | 73 72 m 3H | 72 71 dtd 2H J 9 16 64 | 70 69 dd 1H J 7 14 | 41 40 td 2H J 8 59 | 40 39 dq 1H J 66 132 | 36 35 ddd 1H J 23 45 123 | 34 34 m 2H | 33 33 s 3H | 33 32 ddd 1H J 22 44 122 | 31 30 m 1H | 30 30 m 1H | 29 27 m 3H | 26 25 m 1H | 24 24 d 3H J 7 | 22 21 m 3H | 19 19 p 2H J 59 | 13 12 dd 6H J 66 128

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

C=CCC1CN(c2ncnc3cc(OC)c(OC)cc23)CC1Oc1cnc2ccccc2n1

ir: 1 2 10 4 54 4 5 3 2 3 3 3 4 2 9 19 18 55 18 6 8 5 3 2 3 5 7 12 4 5 3 4 1 7 4 5 3 3 1 5 3 9 8 29 5 8 5 2 3 82 46 4 4 2 5 7 9 8 3 1 4 7 20 64 7 18 6 11 26 41 25 26 13 16 9 23 8 9 2 2 5 9 4 7 30 7 2 2 3 3 17 11 19 4 8 4 12 9 6 26 31 15 5 3 6 5 6 7 10 20 6 3 2 4 12 16 7 7 4 7 7 15 6 6 3 3 3 3 6 2 2 1 2 4 6 33 11 4 16 7 7 16 20 43 23 8 8 83 12 10 1 5 3 2 5 100 42 57 8 2 3 2 1 3 2 2 8 79 6 1 0 0 0 0 1 1 0 0 0 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 0 0 0 0 0 0 0 1 0 0 0 1 1 1 1 1 1 1 2 2 2 1 3 3 2 3 4 6 7 5 11 8 17 65 39 7 8 10 5 2 3 1 1 2 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 84 83 s 1H | 83 82 s 1H | 80 80 dd 1H J 15 83 | 78 78 dd 1H J 14 82 | 77 76 td 1H J 14 84 | 76 75 m 1H | 74 74 s 1H | 72 71 s 1H | 57 56 ddtd 1H J 17 83 110 166 | 52 51 dt 1H J 31 70 | 51 51 ddt 1H J 13 24 165 | 50 49 m 1H | 40 40 m 2H | 39 39 s 3H | 39 38 s 3H | 38 37 m 2H | 26 25 qtd 1H J 18 55 70 | 23 22 m 1H | 21 20 m 1H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

c1cc2nc3c(n2nc1N1CCOCC1)CCCC3

ir: 3 3 2 2 2 1 1 1 2 1 1 1 1 1 1 2 2 1 0 2 5 11 2 2 3 0 11 1 5 7 1 1 2 2 2 1 1 1 1 1 1 1 1 1 1 1 2 1 1 4 3 2 1 0 3 5 6 9 17 100 26 6 2 1 2 4 1 0 1 2 1 2 12 21 5 2 1 1 1 1 1 1 1 1 1 2 5 6 2 2 1 3 3 4 2 2 2 3 2 3 8 6 4 1 2 5 3 1 2 1 2 5 3 8 9 5 9 4 6 7 7 6 6 3 4 3 2 2 3 2 1 4 3 2 2 1 1 1 1 4 4 1 3 3 5 27 29 16 7 4 7 8 5 2 2 1 1 0 0 2 5 22 37 2 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 1 0 1 1 1 1 1 3 2 3 3 2 1 1 2 1 1 7 10 5 4 3 7 14 15 4 3 2 1 1 1 1 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 73 73 m 2H | 38 37 m 4H | 36 36 m 4H | 29 28 m 2H | 29 28 m 2H | 19 18 m 4H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CCOC(=O)c1cnc2sc(CBr)cn2c1=O

ir: 1 4 3 3 1 3 6 15 16 8 3 4 1 2 3 15 10 3 3 2 3 7 4 2 2 2 4 11 8 5 4 4 2 5 3 3 2 3 2 5 3 3 2 3 3 6 4 0 74 15 4 3 3 2 2 2 2 2 2 3 8 6 10 4 15 26 25 16 9 16 11 7 9 7 4 5 18 3 2 1 2 2 2 6 3 2 6 5 6 4 4 20 6 4 28 3 3 2 1 2 3 2 1 2 4 4 8 4 5 4 2 6 6 9 10 5 6 31 27 20 2 2 4 2 3 4 2 2 3 3 1 1 2 2 2 8 15 46 21 3 3 2 2 3 18 43 3 2 2 2 4 33 48 13 3 2 3 6 3 1 3 9 31 100 12 1 2 3 2 0 2 2 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 3 2 2 3 3 5 4 3 2 1 2 4 4 10 12 4 2 2 3 10 48 48 19 3 3 7 2 2 2 1 2 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2; 1HNMR: 88 87 s 1H | 77 76 t 1H J 13 | 43 43 q 2H J 71 | 41 40 d 2H J 13 | 13 12 t 3H J 71

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

O=C1C=C(c2ccc(F)cc2)CCC1

ir: 8 4 1 7 11 5 3 14 11 12 3 6 8 4 2 8 9 4 3 6 10 4 4 6 6 2 2 8 7 3 2 6 7 2 3 7 6 2 4 9 10 2 4 7 5 1 4 8 5 3 20 31 17 10 41 36 70 3 7 12 5 0 4 21 6 12 4 7 11 12 16 8 6 8 17 35 74 29 31 10 6 3 6 6 3 3 6 6 2 3 12 7 2 2 6 5 1 2 7 5 2 4 8 6 1 4 8 6 0 4 10 7 6 11 8 8 11 15 14 18 21 8 11 11 8 8 9 4 1 5 8 4 6 6 6 5 3 16 19 11 3 8 8 3 2 10 12 100 76 10 8 7 6 8 7 3 4 15 14 8 4 9 16 55 33 5 4 2 4 5 4 2 4 6 4 1 4 6 3 1 4 5 3 1 4 5 3 2 4 6 3 2 5 5 3 2 5 5 2 2 5 5 2 2 5 5 2 2 5 4 2 3 5 4 1 3 6 4 1 3 6 4 1 3 6 4 1 3 6 3 1 4 6 3 1 4 6 3 1 4 6 3 1 4 5 3 2 4 5 3 2 5 5 2 2 5 5 2 2 5 5 2 3 5 5 2 3 6 4 2 3 6 5 3 5 9 10 5 4 7 5 6 9 17 33 30 59 53 48 15 9 8 4 5 5 6 3 3 4 5 3 2 4 5 3 2 4 5 3 2 4 5 2 2 5 5 2 3 5 4 2 3 5 4 2 3 5 4 2 3 5 4 2 3 5 4 2 3 5 4 1 3 6 3 1 4 5 3 2 4 5 3 2 4 5 3 2 4 5 3 2 4 5 3 2 4 5 3 2 4 4 2 2 5 4 2 3 5 4 2 3 5 4 2 3 5 4 2 3 5 4 2 3 5 4 2 3 5 3 1; 1HNMR: 76 75 m 2H | 71 71 m 2H | 65 65 p 1H J 9 | 30 29 m 2H | 26 25 td 2H J 10 76 | 17 16 ddt 2H J 66 74 84

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

Cc1ccc(-c2cc(Cl)ccc2OCc2cccc(F)c2F)n1-c1cc(O)cc(C(=O)O)c1

ir: 1 1 1 1 1 1 1 1 1 1 2 1 2 1 2 2 7 8 2 3 7 26 12 3 1 3 2 1 1 2 2 1 2 6 2 1 2 1 2 1 1 1 1 1 1 2 5 7 6 2 1 1 12 28 3 2 1 2 5 1 2 1 2 1 2 2 4 23 7 5 2 6 1 0 1 1 1 4 24 5 4 6 21 30 5 5 5 1 1 1 1 1 3 5 3 1 1 1 1 1 3 2 5 3 1 2 4 1 2 3 12 2 2 1 1 1 1 2 6 2 2 5 4 1 2 3 8 4 1 9 1 1 1 1 3 5 2 3 2 4 3 4 4 0 3 33 0 3 3 1 3 5 11 1 1 1 9 1 1 1 1 2 5 4 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 1 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 0 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 1 1 2 2 2 1 2 2 1 2 2 1 1 2 2 2 1 3 4 18 46 24 37 12 1 2 5 10 100 45 16 3 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1; 1HNMR: 85 85 s 1H | 79 78 t 1H J 22 | 75 75 d 1H J 26 | 74 73 t 1H J 22 | 73 72 dd 1H J 25 89 | 72 72 dddt 1H J 9 19 38 82 | 71 70 m 2H | 70 70 t 1H J 21 | 69 69 d 1H J 88 | 67 66 d 1H J 69 | 66 65 m 1H | 52 52 dd 2H J 7 37 | 24 23 d 3H J 7

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COc1ccc2c3c(c(=O)[nH]c2c1)CCCN3

ir: 3 3 3 4 16 4 2 3 0 3 6 10 4 5 16 18 18 6 7 14 19 8 9 18 17 12 8 8 5 8 7 34 7 2 1 2 2 2 2 11 11 2 5 2 1 1 2 1 3 5 9 2 7 24 24 4 3 3 2 0 2 2 2 7 15 8 16 12 6 3 2 4 3 1 9 8 5 2 3 3 8 3 2 2 2 6 1 1 1 4 2 2 1 8 2 2 3 4 36 3 2 1 1 1 1 1 2 2 4 2 8 14 5 3 2 3 18 4 2 1 2 4 5 2 4 3 1 3 1 1 1 1 1 2 1 7 2 1 2 3 21 34 2 1 6 3 2 1 2 2 9 7 10 7 45 22 30 11 3 2 1 4 10 80 8 0 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 3 1 2 2 2 2 1 1 2 4 6 3 5 70 14 8 2 1 3 6 8 6 32 100 52 7 2 1 1 2 1 3 2 2 2 2 5 9 39 8 1 2 2 1 1 1 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 76 75 d 1H J 85 | 69 68 m 2H | 66 65 t 1H J 40 | 38 38 s 3H | 34 33 m 2H | 26 25 dd 2H J 59 68 | 20 19 m 2H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CC(=O)c1nc2c(OCc3ccccc3)cccc2n1C

ir: 3 1 0 2 2 1 1 3 2 3 18 8 4 3 3 4 2 9 4 7 5 5 1 1 1 4 2 1 3 20 2 10 6 1 1 2 2 2 5 42 67 10 4 1 2 5 16 52 14 2 1 1 1 0 1 1 1 0 1 1 1 1 1 2 3 14 7 4 4 7 7 5 8 5 3 3 4 5 5 5 2 5 4 14 1 1 1 1 3 14 9 10 3 1 1 3 1 2 3 1 1 1 1 1 1 2 1 1 0 2 2 2 1 2 2 10 11 7 27 14 7 19 7 3 2 5 37 18 8 3 19 53 4 2 11 22 3 4 11 1 2 5 53 41 10 2 4 1 2 2 1 6 6 2 1 0 1 2 5 5 12 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 0 1 1 0 0 1 1 1 1 1 1 0 1 1 1 0 0 1 1 0 0 1 1 1 1 1 1 1 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 4 1 1 1 1 2 1 3 1 2 2 4 2 8 4 16 17 34 100 85 10 7 4 2 1 2 2 1 1 1 1 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0; 1HNMR: 75 73 m 6H | 73 73 m 2H | 71 70 dd 1H J 11 84 | 52 51 t 2H J 9 | 40 39 s 2H | 27 27 s 2H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CN(CCN)Cc1cncc(-c2cccnc2)c1

ir: 1 1 1 3 2 2 1 1 1 0 1 2 1 3 1 1 1 1 0 1 1 0 0 1 1 0 2 1 3 1 1 3 3 10 10 1 2 1 0 1 2 1 1 2 1 0 1 1 1 1 0 1 1 3 2 1 1 1 1 1 2 4 4 7 10 1 1 3 2 3 3 2 2 6 14 11 3 2 2 3 16 3 2 2 2 1 1 1 1 2 1 1 0 1 2 1 0 1 2 3 2 1 1 1 0 1 1 1 0 1 1 3 7 2 2 1 1 2 2 1 1 2 2 9 3 2 3 3 4 5 3 8 3 6 5 1 1 1 1 2 1 1 1 0 0 1 1 0 0 1 1 1 2 2 1 0 2 3 3 0 1 1 1 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 1 0 1 1 1 0 1 1 0 1 1 1 1 1 2 5 4 1 1 1 1 0 1 1 1 1 2 1 2 4 3 9 5 2 2 3 1 100 20 2 0 1 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0; 1HNMR: 89 89 d 1H J 20 | 87 87 t 1H J 17 | 87 86 m 2H | 81 81 dt 1H J 18 75 | 78 78 tt 1H J 9 18 | 74 73 dd 1H J 48 76 | 37 37 t 2H J 9 | 29 28 tt 2H J 53 68 | 27 27 t 2H J 51 | 23 23 s 3H | 14 13 t 2H J 66

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COc1ccc(SC(=O)c2ccc(O)cc2)cc1

ir: 11 11 6 4 6 4 3 4 5 4 6 6 6 12 15 6 2 3 2 3 3 2 2 3 10 3 2 2 3 2 2 2 5 8 2 2 2 2 1 2 2 2 2 2 2 1 1 2 2 1 3 6 8 4 37 27 7 10 3 4 4 8 13 4 2 3 2 2 4 3 2 2 2 2 2 2 2 4 5 4 33 7 16 4 9 4 5 6 13 2 2 3 2 7 10 2 5 2 2 2 1 2 2 2 2 2 8 2 2 16 3 2 2 2 2 2 2 3 2 2 2 2 2 4 3 8 7 4 2 2 2 1 1 2 2 2 3 4 39 6 3 2 1 3 4 12 21 3 7 9 19 6 10 3 2 2 2 2 1 2 2 2 5 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 2 3 3 2 2 2 2 1 2 2 2 1 2 2 2 2 2 3 5 6 26 34 16 6 4 9 6 0 9 100 3 3 2 1 2 2 2 1 2 2 1 1 2 2 1 1 1 1 1 1 2 1 1 2 2 2 3 2 2 2 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 88 87 s 1H | 78 78 m 2H | 75 75 m 2H | 70 69 m 4H | 38 38 s 3H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

N#CN=C1NCCN1CC#CCNC(=O)C(O)(c1ccccc1)C1CCCCC1

ir: 31 39 34 31 10 28 43 23 21 32 10 31 29 44 34 38 49 10 16 19 17 12 9 8 14 8 10 11 25 21 11 10 29 19 27 11 35 41 43 39 36 22 22 25 9 2 16 19 10 10 6 8 7 2 13 7 9 3 6 16 8 5 9 8 7 12 8 10 9 13 15 13 4 6 7 16 19 23 13 34 54 34 33 35 28 28 16 29 30 13 14 10 5 15 14 20 9 20 22 11 12 8 11 6 3 6 9 11 16 22 26 12 48 30 23 22 9 21 28 26 5 19 27 30 19 16 23 22 29 28 28 12 6 40 50 43 9 8 10 7 11 20 17 58 48 65 64 27 7 10 23 23 100 35 19 6 4 5 6 4 5 9 5 3 4 5 4 3 4 5 4 3 3 5 4 2 3 6 4 2 4 6 4 0 38 38 63 10 6 5 5 3 4 5 3 3 4 4 3 3 4 4 3 3 5 4 3 4 5 5 3 4 5 4 3 4 5 4 3 4 5 4 3 4 5 4 3 4 5 4 2 4 5 4 3 4 5 4 3 4 5 4 2 4 5 4 3 4 5 3 3 4 5 4 4 5 5 3 4 5 5 4 3 5 5 3 3 5 4 3 4 6 6 5 8 9 10 6 11 9 7 9 10 16 32 15 21 25 45 10 10 10 8 9 15 49 21 4 9 6 5 6 9 9 6 5 8 15 14 13 44 72 79 96 38 15 8 7 6 5 4 4 5 5 4 3 5 4 4 4 5 5 3 4 7 4 4 4 5 4 3 4 5 4 3 4 5 4 3 4 5 4 3 4 5 3 3 4 5 3 3 4 4 4 3 4 4 3 3 4 4 3 3 4 4 3 3 5 4 3 3 4 4 3 3 4 4 3 4 5 4 3 3 5 4 3 4 5 4 3; 1HNMR: 83 83 t 1H J 12 | 75 74 m 2H | 74 73 m 3H | 71 71 t 1H J 32 | 46 46 s 1H | 43 42 t 2H J 25 | 41 40 m 2H | 38 38 m 2H | 35 34 q 2H J 13 | 26 25 p 1H J 64 | 19 18 m 2H | 17 14 m 7H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CC(C)c1cccc(Nc2c(C#N)cnc3cnc(F)cc23)c1

ir: 5 3 1 4 32 9 6 7 6 5 3 7 17 19 7 6 29 6 4 7 6 2 6 10 16 36 35 37 12 5 9 19 11 3 15 34 15 9 4 4 14 2 3 20 5 0 9 100 85 32 12 7 4 3 2 5 11 12 3 14 12 0 3 5 2 5 12 28 6 17 26 6 4 2 3 3 2 2 4 4 2 5 4 4 4 1 3 4 11 7 4 42 10 2 11 16 2 3 3 2 2 4 18 7 4 8 28 23 1 5 9 7 22 12 3 11 5 3 9 5 4 12 16 6 5 11 5 4 9 10 43 16 3 4 8 37 82 5 8 10 64 27 6 2 6 13 7 64 2 5 7 4 3 10 6 19 18 8 24 2 3 4 4 50 13 8 6 0 2 3 2 0 2 3 2 1 2 3 2 0 2 4 63 3 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 3 1 1 2 2 1 1 2 2 1 1 3 2 1 3 3 2 1 2 3 2 2 3 6 4 3 4 8 11 9 10 70 72 7 6 6 5 1 3 3 2 3 5 3 3 2 3 4 3 2 4 13 26 25 14 68 51 16 30 9 8 4 2 3 3 3 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 3 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1; 1HNMR: 91 91 s 1H | 90 90 d 1H J 44 | 85 84 s 1H | 80 79 d 1H J 121 | 73 72 t 1H J 78 | 70 69 m 2H | 69 68 ddd 1H J 11 22 77 | 29 28 dpd 1H J 57 66 76 | 13 12 d 6H J 66

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CCCc1c(C(=O)C(C)C)c2ccc(NC(=O)NC)cc2n1Cc1ccccc1Cl

ir: 1 4 7 6 5 3 6 2 0 3 4 2 0 3 4 2 0 4 6 3 5 19 18 6 14 3 3 2 2 3 3 3 4 8 5 5 8 10 30 26 55 27 28 14 7 9 6 3 4 5 5 4 8 8 9 10 27 4 3 2 3 6 2 2 4 5 9 18 4 11 5 3 4 8 8 3 5 5 3 1 3 4 2 2 3 3 2 6 9 6 5 5 6 4 2 3 3 4 2 3 4 7 12 12 7 5 6 7 11 5 3 4 5 7 3 3 5 4 4 6 6 8 3 12 16 7 4 4 4 4 3 5 13 5 2 7 27 15 5 3 6 9 8 7 8 4 5 8 23 100 15 46 26 3 7 8 61 3 3 6 3 0 2 4 3 4 3 4 2 0 2 4 2 0 2 4 2 0 2 4 2 1 2 3 2 1 2 3 2 1 3 3 1 1 3 3 1 1 3 3 1 1 3 3 1 1 3 3 1 1 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 4 2 0 2 3 2 0 2 3 2 1 2 3 2 1 2 3 2 1 3 3 2 1 3 3 1 1 3 3 1 1 3 3 1 1 3 3 1 1 3 3 1 2 5 4 1 2 4 3 3 2 5 3 2 4 7 4 5 13 28 29 51 24 14 8 5 3 4 3 4 3 2 3 3 3 4 4 3 3 4 5 5 13 13 56 20 38 18 9 6 5 4 2 2 3 2 2 2 3 3 2 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 2 2 1 2 2 2 2 2 3 2 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3; 1HNMR: 83 83 s 1H | 79 78 d 1H J 82 | 76 76 d 1H J 20 | 75 74 dd 1H J 21 81 | 74 73 m 1H | 73 72 m 3H | 61 60 q 1H J 47 | 55 55 s 2H | 33 32 hept 1H J 68 | 29 28 t 2H J 64 | 27 27 d 3H J 46 | 17 16 h 2H J 68 | 12 11 d 6H J 69 | 10 9 t 3H J 70

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

Cc1c(OCc2ccccc2)c(=O)ccn1CC(O)CO

ir: 4 2 5 1 9 5 2 2 2 2 1 1 1 1 0 0 0 1 1 1 1 1 1 0 1 1 3 1 1 1 0 0 1 1 0 0 0 1 2 3 1 1 1 0 1 1 0 1 0 1 0 3 2 7 1 0 0 0 0 0 0 0 0 0 0 1 1 1 0 1 1 1 1 1 1 1 1 0 1 0 0 1 1 1 1 1 4 6 4 11 2 1 2 8 1 0 1 1 0 1 1 2 2 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 1 1 1 1 0 1 0 0 0 0 0 1 1 0 0 0 0 0 0 2 4 1 1 7 1 0 1 1 2 0 0 0 0 0 0 0 0 0 17 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 1 1 2 2 2 10 4 2 4 4 2 1 2 100 4 2 2 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 75 74 dt 1H J 9 84 | 74 73 m 5H | 64 64 d 1H J 84 | 52 51 s 2H | 41 40 t 1H J 59 | 39 38 m 3H | 38 37 ddd 1H J 48 59 118 | 36 35 ddd 1H J 9 58 106 | 35 34 ddd 1H J 48 59 119 | 22 21 s 2H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

NC1(c2nc3cccc(OCc4ccccc4)c3[nH]2)CCN(c2ncnc3[nH]ccc23)CC1

ir: 2 3 5 4 2 2 1 1 1 1 1 3 4 1 2 1 13 2 1 2 1 3 4 3 3 9 1 4 4 9 7 8 7 2 2 21 3 3 6 8 31 9 12 14 7 3 1 1 28 3 1 3 1 1 2 2 10 4 2 1 4 2 7 9 4 2 1 4 11 12 8 2 2 1 1 2 5 7 1 3 2 3 5 15 4 1 0 1 3 9 1 3 4 4 0 1 5 3 2 18 14 4 1 17 1 2 0 1 1 1 1 2 2 2 3 2 2 2 1 3 3 2 2 2 11 4 6 8 6 8 11 17 16 14 7 5 3 3 5 2 2 2 15 7 9 6 8 2 1 0 1 3 3 23 15 77 2 28 10 1 1 2 1 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 1 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 1 1 1 1 1 1 1 1 1 2 5 4 2 27 16 4 6 10 5 2 1 1 1 1 2 2 10 11 3 3 5 2 3 3 1 100 7 3 4 7 40 10 4 2 1 1 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 82 82 s 1H | 76 75 dd 1H J 13 73 | 74 74 dq 2H J 10 74 | 74 73 m 5H | 71 71 dd 1H J 57 64 | 70 69 dd 1H J 12 81 | 67 66 d 1H J 57 | 51 51 m 4H | 42 41 ddd 2H J 44 71 145 | 37 36 ddd 2H J 43 70 143 | 25 24 ddd 2H J 44 71 150 | 22 21 ddd 2H J 43 70 148

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COC(=O)NCc1ccc(Cl)c(CO)c1

ir: 10 8 8 6 5 4 6 2 1 2 1 3 3 1 0 2 2 3 4 2 3 2 2 7 12 10 39 17 23 8 3 2 3 2 4 1 1 1 2 2 2 2 1 0 0 1 1 0 1 1 1 2 1 7 8 2 2 1 1 1 3 4 7 3 2 1 1 1 4 3 1 0 2 3 1 1 1 1 1 0 4 3 4 6 5 40 12 13 21 6 4 4 4 4 4 4 2 3 4 1 2 0 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 2 3 6 3 5 7 4 4 2 1 4 1 2 1 1 1 0 0 0 0 0 1 2 16 2 3 19 23 9 6 1 26 13 5 3 1 2 2 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 1 1 1 0 1 2 0 1 2 1 1 1 2 3 1 2 3 5 3 1 1 2 3 6 6 11 17 12 4 4 6 5 9 11 100 13 9 3 4 4 1 1 1 1 0 2 2 2 5 2 19 12 6 4 2 1 2 1 1 1 1 1 1 1 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 73 72 m 2H | 72 71 dp 1H J 9 18 | 66 66 t 1H J 58 | 47 47 dd 2H J 8 59 | 44 44 dt 2H J 8 58 | 37 37 s 2H | 29 29 t 1H J 59

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CCOC(=O)OCCn1nc(-c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)c2cccnc21

ir: 9 8 8 7 3 4 7 3 5 2 5 2 4 3 2 2 5 3 3 2 1 2 2 2 2 2 3 2 5 3 3 2 2 1 2 5 6 9 19 15 6 14 8 3 3 2 2 2 1 2 1 1 1 2 3 4 2 2 1 1 2 2 2 6 5 10 4 3 6 5 5 1 3 2 3 3 4 4 1 5 7 100 8 8 4 5 8 2 2 11 8 3 1 2 5 2 1 2 1 2 4 18 7 2 0 4 4 6 5 5 9 10 9 5 5 18 27 10 3 6 6 4 3 4 3 3 4 5 6 7 11 2 6 7 4 6 4 3 3 4 6 3 10 6 5 6 13 18 7 16 7 0 1 1 3 12 3 3 6 1 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 3 2 2 3 2 2 2 2 2 2 2 5 8 8 9 8 14 11 8 3 2 2 1 16 16 14 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 86 85 dd 1H J 22 35 | 83 83 dd 1H J 21 78 | 75 75 s 2H | 74 74 dd 1H J 34 78 | 57 56 s 1H | 47 46 m 5H | 43 42 q 2H J 64 | 15 15 s 16H | 13 13 t 4H J 64

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CC(CC=O)COCc1ccccc1

ir: 1 2 2 2 1 1 1 2 0 2 1 1 1 1 1 1 1 2 4 3 2 5 2 1 3 2 1 1 1 3 8 16 4 5 2 5 2 3 4 100 77 3 5 3 4 3 2 1 1 1 1 1 4 2 2 2 4 6 2 1 2 4 12 4 4 1 4 6 5 5 2 2 7 11 8 2 2 4 1 1 1 1 0 1 1 1 0 1 6 4 1 1 1 1 2 2 2 3 6 1 2 4 7 7 9 6 5 4 2 4 2 3 3 1 0 1 2 4 2 8 6 3 3 3 2 1 3 1 1 1 1 2 2 2 8 4 2 1 1 1 1 1 6 7 3 1 6 4 9 13 7 6 5 1 1 1 1 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 1 0 0 0 1 1 0 1 1 1 1 1 2 2 3 2 2 2 0 4 3 6 4 11 6 18 53 40 6 4 1 1 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 96 96 td 1H J 18 65 | 74 73 m 5H | 45 44 m 2H | 36 35 dd 1H J 57 110 | 33 33 dd 1H J 57 110 | 25 24 ddd 1H J 65 86 161 | 22 21 ddd 1H J 64 86 159 | 20 18 m 1H | 10 10 d 2H J 80

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

O=C1CCCc2sc3ccccc3c21

ir: 12 7 4 7 25 7 10 8 11 5 2 8 11 7 3 13 14 10 5 8 9 4 3 8 9 4 3 8 8 10 3 11 9 5 5 9 8 3 5 10 9 2 28 9 69 8 100 14 10 0 8 16 12 6 10 12 6 1 6 16 6 2 7 11 5 3 7 13 6 5 26 13 5 3 10 10 6 3 8 10 5 5 9 9 7 6 12 13 4 9 16 19 4 4 33 8 3 5 10 10 3 6 10 7 2 5 10 7 2 10 23 8 3 10 20 25 20 9 14 9 5 11 14 6 3 8 12 5 4 8 10 6 9 10 16 8 62 12 20 10 5 9 14 20 4 10 10 4 55 11 9 1 99 51 23 5 4 11 9 8 8 13 7 2 5 10 6 1 6 11 6 1 6 10 6 2 6 10 5 2 7 10 5 2 7 9 5 3 7 9 4 3 8 9 4 3 8 8 4 4 8 8 4 4 8 8 3 4 9 7 3 5 9 7 3 5 9 7 2 5 10 6 2 6 10 6 2 6 10 6 2 6 10 6 2 6 9 5 3 7 9 5 3 7 9 5 3 7 9 5 3 8 8 4 4 8 8 4 4 8 8 4 4 8 7 4 5 9 8 3 5 9 7 6 8 15 10 10 6 10 7 4 11 28 15 24 24 37 36 61 12 13 8 3 8 9 6 4 7 9 5 4 7 9 5 4 8 8 5 4 8 8 4 4 8 8 4 4 8 7 4 5 8 7 3 5 8 7 3 5 9 7 3 5 9 6 3 6 9 6 3 6 9 6 3 6 9 6 3 6 9 5 3 7 9 5 3 7 8 5 4 7 8 5 4 7 8 4 4 7 8 4 4 8 7 4 5 8 7 4 5 8 7 4 5 8 7 3 5 8 6 3 6 9 6 3 6 9 6 3; 1HNMR: 81 80 m 1H | 79 78 m 1H | 75 74 m 2H | 30 28 m 2H | 28 28 m 2H | 21 20 dq 2H J 61 76

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

O=C(NCc1ccc(Cl)cc1Cl)N1CC2CNC2C1

ir: 1 1 4 2 3 2 2 1 2 2 5 3 2 1 2 5 1 2 4 3 3 5 5 10 2 2 1 3 3 1 1 2 7 2 2 4 5 38 34 14 18 4 5 16 1 5 4 1 3 3 2 3 10 11 19 23 3 5 3 2 13 3 5 15 11 73 59 31 11 4 3 1 2 3 4 26 13 2 2 2 25 9 6 4 3 3 5 5 5 10 6 11 4 8 6 5 3 17 100 3 6 3 1 3 6 5 8 2 4 2 1 4 5 2 0 2 4 3 3 4 6 4 6 7 9 3 1 2 3 2 1 3 2 1 1 1 2 1 2 0 15 0 0 3 5 6 9 10 22 4 3 25 20 6 2 1 1 1 1 5 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 3 2 2 2 7 4 4 6 4 11 30 10 3 2 2 1 2 3 1 1 1 1 1 1 1 1 2 1 2 3 27 5 3 14 30 7 11 1 7 3 2 1 1 2 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 75 74 d 1H J 22 | 74 74 dt 1H J 9 82 | 73 73 dd 1H J 21 82 | 63 62 t 1H J 60 | 46 46 dd 2H J 7 60 | 38 38 m 1H | 38 37 dd 1H J 23 127 | 36 35 m 3H | 33 32 ddd 1H J 24 44 112 | 30 29 ddd 1H J 22 42 112 | 24 24 dp 1H J 23 33 | 13 12 q 1H J 44

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

Cc1cc(O)nc(N2CCCC2c2cc(-c3ccccn3)no2)n1

ir: 1 1 2 2 3 6 4 2 1 1 7 2 1 2 2 2 4 6 6 4 2 1 1 1 1 1 1 1 2 1 1 1 2 1 2 3 32 5 3 7 3 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 3 1 2 1 1 3 2 3 3 8 7 4 3 9 4 3 3 6 4 3 1 2 8 5 6 3 2 1 1 1 1 1 1 1 1 3 2 1 1 1 1 1 1 1 1 3 1 1 1 1 1 1 2 1 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 2 2 3 6 2 2 1 1 1 1 1 2 1 1 0 0 1 1 0 1 52 21 3 2 1 1 2 1 1 8 10 4 100 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 8 7 5 7 3 2 1 1 1 1 1 11 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 86 86 dd 1H J 17 41 | 81 80 dd 1H J 14 83 | 78 77 m 1H | 73 73 ddd 1H J 13 40 71 | 70 70 d 1H J 7 | 57 57 s 1H | 51 50 td 1H J 7 60 | 39 38 ddd 1H J 46 64 150 | 38 37 ddd 1H J 47 65 148 | 26 25 ddt 1H J 59 77 134 | 23 22 m 1H | 23 23 s 3H | 21 20 ddtd 1H J 47 62 79 123 | 20 19 ddtd 1H J 48 62 79 124

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

O=C1NN=CC1=CNCCC(F)=C(F)F

ir: 1 1 2 1 0 1 1 0 0 0 1 0 0 0 1 1 3 3 1 1 3 7 4 3 10 15 13 10 8 10 7 4 1 1 2 2 1 2 3 5 3 4 2 1 0 1 2 2 7 15 30 23 6 2 1 1 0 0 1 1 1 0 1 2 0 0 0 0 0 0 1 0 1 1 1 2 2 1 1 1 0 0 6 4 1 1 2 1 1 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 1 2 10 3 2 2 1 1 1 9 8 2 1 1 1 1 1 2 3 2 4 1 1 2 2 2 5 4 3 2 4 6 17 9 10 4 2 1 1 0 0 0 1 3 14 2 1 2 0 0 1 0 0 1 3 15 2 2 3 8 30 3 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 1 0 0 0 0 0 0 1 1 2 4 2 1 2 0 0 0 0 0 0 0 1 0 0 1 1 0 1 1 1 3 5 8 13 16 19 100 8 4 4 3 1 1 2 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 92 92 dt 1H J 56 70 | 80 79 d 1H J 11 | 76 75 dq 1H J 9 70 | 35 34 qdd 2H J 9 34 55 | 26 25 dtt 2H J 42 55 234

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COc1c(N2CCC(n3ccnn3)C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12

ir: 3 11 18 8 4 10 17 11 3 10 14 11 15 12 16 7 7 12 20 9 8 11 18 18 90 100 54 11 8 14 14 4 10 14 13 4 8 15 13 4 9 21 15 15 23 18 18 0 51 37 15 10 13 16 9 1 8 16 11 3 11 15 8 7 13 19 8 4 17 23 9 8 16 14 6 3 12 39 37 18 16 20 9 9 22 17 13 11 17 14 8 7 26 17 5 9 28 15 4 7 16 13 11 27 30 22 8 11 17 10 6 10 17 15 4 11 15 11 9 10 15 8 3 10 13 7 4 11 13 8 5 26 19 6 3 10 31 6 5 11 15 5 5 18 41 12 8 17 27 42 18 19 17 5 9 16 12 4 7 14 13 7 10 17 13 2 7 13 8 2 8 13 7 2 8 13 7 2 8 12 7 3 9 12 6 3 9 12 6 3 9 11 5 4 10 11 5 4 10 10 5 5 11 10 4 5 11 10 4 6 11 9 3 6 12 9 3 7 12 8 3 7 12 8 2 7 13 8 3 8 13 7 2 8 13 7 3 8 12 6 3 9 11 6 4 9 11 6 4 9 11 5 4 10 10 5 5 10 10 5 5 10 10 5 6 11 10 4 6 12 10 4 7 12 10 5 8 13 10 6 12 16 10 9 15 16 11 9 12 18 19 16 19 26 8 5 20 61 13 5 9 12 6 4 9 11 6 4 9 10 5 5 10 10 5 5 10 9 5 5 10 9 4 6 11 9 4 6 11 8 4 7 11 8 3 7 11 8 3 7 12 7 3 7 12 7 3 8 11 7 4 8 11 7 4 8 11 6 4 9 10 6 5 9 10 6 5 9 10 5 5 10 9 5 6 10 9 5 6 10 9 5 6 10 8 4 7 11 8 4 7 11 8 4 7 11 8 4 7 11; 1HNMR: 86 86 d 1H J 16 | 78 77 m 2H | 77 76 d 1H J 25 | 52 51 ttd 1H J 7 16 24 | 41 41 pd 1H J 17 63 | 40 39 m 1H | 38 37 m 2H | 37 36 s 3H | 36 35 ddd 1H J 46 63 111 | 23 22 dddd 1H J 24 44 65 132 | 20 20 dddd 1H J 24 46 67 133 | 13 12 m 2H | 11 10 m 2H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COc1cc(-c2cnc3cccc(Br)c3n2)cc(OC)c1OC

ir: 0 1 1 1 1 1 18 19 4 2 1 1 1 1 1 1 1 1 1 1 1 3 3 15 17 2 1 1 1 4 5 2 2 2 1 1 1 1 1 2 2 2 1 0 3 64 100 10 2 0 1 6 2 6 4 5 6 6 2 1 1 1 7 4 8 2 3 16 13 0 6 17 10 11 3 5 2 1 2 3 3 2 1 1 1 0 1 1 1 3 3 1 1 1 1 3 7 14 1 1 1 1 1 2 2 1 3 7 2 1 1 4 6 1 1 1 1 2 2 6 4 2 1 4 6 3 2 2 1 1 0 1 1 1 9 9 1 1 2 5 10 5 9 2 1 7 1 1 1 0 0 1 1 0 1 1 1 1 1 1 1 1 1 1 5 4 2 0 1 0 0 1 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 4 4 5 4 15 22 16 4 2 2 1 1 1 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 93 93 s 1H | 81 80 dd 1H J 12 83 | 78 78 dd 1H J 12 92 | 76 76 dd 1H J 84 93 | 73 73 s 2H | 39 39 s 6H | 39 38 s 3H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

Cc1cc(=O)n(-c2ccc(NCCCN3CCOCC3)c(F)c2)c(C)n1

ir: 5 8 10 2 5 14 8 6 3 10 3 4 27 16 11 23 35 14 6 4 2 3 19 3 6 3 2 23 20 3 3 9 1 2 2 1 2 16 14 8 6 20 5 2 1 1 1 1 1 5 4 6 3 7 59 39 4 2 4 5 5 5 2 7 9 11 17 11 17 3 14 12 31 6 2 1 1 1 1 2 1 13 28 5 5 11 2 2 2 3 3 2 3 3 4 2 2 2 7 36 5 16 8 3 2 14 0 1 2 2 1 3 6 3 1 3 4 6 23 7 4 3 4 4 26 11 2 3 2 8 3 5 17 12 16 6 6 2 1 2 2 2 16 3 3 33 3 3 12 34 30 9 16 50 9 3 2 2 1 3 9 100 2 17 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 0 0 1 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 1 2 2 2 2 2 3 2 3 3 3 5 8 16 11 13 31 29 12 9 3 4 1 1 2 1 1 1 1 1 2 2 1 1 1 3 3 12 23 23 27 52 27 20 2 2 2 2 2 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 73 73 dd 1H J 21 121 | 72 72 dd 1H J 22 97 | 70 69 dd 1H J 47 97 | 58 57 q 1H J 13 | 49 49 td 1H J 37 49 | 37 37 m 4H | 33 32 td 2H J 49 59 | 28 28 t 2H J 58 | 28 27 m 4H | 24 24 m 5H | 20 19 p 2H J 58

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

O=C(O)CSc1nc2cc(C#Cc3ccc(CO)cc3)c(Cl)cc2[nH]1

ir: 10 6 9 9 5 4 4 3 5 6 8 17 21 9 16 9 19 48 36 27 75 23 14 26 9 4 8 5 5 3 3 7 4 2 5 2 2 4 3 2 4 5 5 8 6 7 7 5 6 3 8 0 7 13 7 6 8 9 7 4 2 1 2 3 3 7 4 4 10 10 3 3 2 4 4 10 17 13 59 52 22 4 10 15 13 37 25 10 13 10 3 2 5 3 2 3 4 3 8 4 2 3 2 2 4 46 3 5 6 2 3 2 2 6 5 4 3 3 4 6 6 11 6 12 6 10 8 6 2 3 2 2 2 2 2 13 0 2 3 18 2 4 18 100 9 8 5 29 5 2 1 5 5 9 17 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 1 4 4 3 3 3 3 3 3 10 14 26 36 28 11 9 9 4 4 8 22 42 52 98 85 11 5 2 2 2 3 3 1 2 1 2 1 2 6 44 20 4 2 2 2 2 1 1 2 1 1 1 1 1 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 90 89 s 1H | 79 78 s 1H | 75 75 s 1H | 75 74 m 2H | 73 72 dq 2H J 9 75 | 47 46 dt 2H J 9 56 | 39 39 s 2H | 28 27 t 1H J 57

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

Cc1cc(OCCN2CCOCC2)ccc1Br

ir: 2 6 22 34 11 7 1 2 3 3 6 21 6 11 11 6 6 4 4 1 6 3 2 2 2 70 10 5 4 13 3 2 1 1 1 1 3 1 1 2 1 14 13 3 2 2 4 0 3 14 58 6 7 43 39 46 14 11 16 11 10 4 5 13 24 35 13 9 9 21 47 42 100 61 6 4 3 7 1 3 3 43 98 7 24 21 13 4 3 2 12 12 44 9 4 2 2 4 17 11 58 37 9 2 6 5 1 3 3 1 0 2 5 12 15 4 8 4 3 3 1 2 2 2 9 4 4 2 3 2 2 2 2 2 3 3 4 2 2 19 40 7 1 0 0 1 1 2 83 6 5 7 16 62 6 4 2 1 1 3 20 15 4 2 1 0 1 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 1 1 1 1 1 2 4 6 4 5 5 6 6 15 3 4 2 5 7 20 50 12 36 47 33 6 5 5 3 2 1 1 3 2 1 1 1 1 1 1 1 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 74 74 d 1H J 90 | 68 68 m 1H | 68 67 dd 1H J 22 90 | 41 41 t 2H J 59 | 37 37 t 4H J 47 | 27 27 t 2H J 59 | 26 25 td 4H J 23 44 | 24 23 s 2H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

Cc1ncsc1S(=O)(=O)N(Cc1cc(=O)[nH]c2c(F)cccc12)c1cccc(Cl)c1

ir: 2 2 2 2 2 2 8 4 9 6 4 3 13 19 71 6 4 11 6 4 2 9 29 13 8 3 1 4 4 1 1 20 1 2 3 42 3 1 2 2 5 56 8 7 2 1 2 14 43 13 4 3 2 0 1 2 3 0 2 2 5 8 9 3 7 5 15 53 19 8 7 25 22 3 1 3 3 6 4 2 3 3 14 22 16 4 56 25 8 6 35 3 2 4 2 4 15 2 3 2 0 1 2 1 0 1 3 3 4 7 2 1 0 1 2 2 3 17 4 3 3 4 6 18 1 3 3 5 2 1 2 2 3 16 7 2 2 1 10 9 9 11 100 11 4 5 2 1 1 1 2 6 5 13 10 28 19 2 1 4 5 5 2 15 37 2 1 0 1 2 1 0 1 1 1 0 1 2 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 2 1 1 1 1 2 1 1 2 2 2 1 3 5 8 11 25 30 35 9 8 5 1 1 2 2 1 0 1 2 1 0 1 2 2 1 2 2 3 5 8 8 79 54 7 4 2 1 2 2 3 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 87 87 s 1H | 76 75 dd 1H J 16 81 | 74 72 m 5H | 71 71 t 1H J 22 | 70 70 ddd 1H J 14 21 77 | 66 65 m 1H | 55 55 d 2H J 13 | 26 25 s 3H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CC(C)CN1C(=O)c2ccc(C(C)(C)C)cc2C1CC(=O)NC(=N)N

ir: 1 3 1 2 6 6 7 8 26 7 7 55 23 6 2 3 1 1 1 2 2 3 2 4 1 1 2 1 14 18 3 3 33 11 47 5 5 2 4 5 12 22 17 3 3 1 1 1 4 0 1 1 2 5 6 8 3 1 7 19 3 1 2 3 2 1 3 2 6 4 1 2 1 2 4 1 1 2 39 3 1 1 1 1 1 3 1 1 1 1 3 5 7 5 7 7 4 5 2 2 3 4 2 1 1 1 2 3 1 1 3 2 0 7 34 3 2 2 6 7 15 7 3 3 1 1 10 30 2 3 6 3 3 2 1 2 2 1 2 3 1 1 1 0 1 26 6 4 4 9 45 15 9 11 5 6 9 2 1 0 1 1 1 3 2 2 1 0 2 19 80 19 2 1 1 1 1 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 1 3 1 1 2 1 1 2 4 2 4 11 5 8 33 14 1 2 2 18 10 2 1 2 0 1 2 1 2 53 100 4 6 4 2 3 13 24 6 2 27 23 3 2 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 90 90 s 1H | 82 81 s 1H | 78 77 d 1H J 84 | 76 76 m 1H | 74 74 dd 1H J 22 82 | 59 59 s 2H | 48 47 m 1H | 36 36 dd 1H J 52 113 | 35 34 dd 1H J 51 114 | 29 28 dd 1H J 69 160 | 27 26 dd 1H J 69 160 | 20 18 m 1H | 13 13 s 8H | 9 9 dd 7H J 70 115

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COC(=O)c1ccc2nc(-c3ccc(F)cc3F)c(N(C)C(C)C)nc2c1

ir: 2 1 2 2 12 7 2 1 2 11 5 2 3 3 4 1 4 4 4 2 20 6 1 3 5 49 5 8 2 9 1 1 4 1 1 3 5 2 4 3 1 1 0 1 1 3 1 1 1 3 6 2 1 3 7 17 6 31 2 3 1 0 1 3 4 15 21 13 7 7 3 2 0 1 2 7 2 1 2 2 1 1 2 1 1 5 4 5 1 1 1 1 2 0 1 1 0 1 1 1 7 4 4 7 18 61 5 5 4 7 16 2 1 5 12 8 17 4 6 6 3 7 11 9 22 16 4 2 1 4 3 3 3 2 1 1 1 1 5 1 0 1 1 1 7 6 4 100 20 1 0 5 7 1 10 1 2 4 1 1 1 14 1 0 0 1 1 0 0 0 0 0 0 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 0 0 0 1 1 1 2 3 3 2 6 5 6 76 21 4 3 2 1 1 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 85 85 dd 1H J 7 20 | 82 81 m 2H | 80 79 dt 1H J 50 84 | 72 71 td 1H J 27 121 | 71 70 ddd 1H J 27 84 101 | 48 46 m 1H | 39 39 s 2H | 33 32 d 3H J 14 | 13 13 d 6H J 73

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CCCS(=O)CCCN(CC)C[C@@H](O)COc1ccc(C#N)cc1

ir: 1 2 4 2 0 2 2 2 2 3 3 2 4 6 5 2 4 8 4 6 6 3 4 3 12 5 2 1 1 3 2 2 3 1 2 1 1 4 2 1 1 3 1 1 1 3 1 0 1 1 1 0 1 1 1 4 6 4 1 1 1 2 3 1 1 2 2 3 5 4 4 4 5 2 1 1 2 2 1 2 1 2 4 3 2 2 7 6 3 4 10 13 7 5 2 1 3 2 3 1 3 1 2 2 1 1 1 2 8 2 1 1 2 1 1 1 2 1 2 3 2 2 2 1 1 4 1 2 1 1 0 1 2 1 0 2 2 1 1 1 1 1 0 1 2 1 7 8 1 1 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 0 1 0 0 0 1 1 0 1 1 0 0 1 1 1 1 7 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 1 2 3 2 1 2 2 1 2 3 2 8 6 3 2 9 3 2 2 4 6 33 100 86 10 3 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1; 1HNMR: 77 76 m 2H | 71 70 m 2H | 42 41 m 2H | 39 38 m 1H | 35 35 m 1H | 29 28 m 1H | 28 25 m 9H | 20 19 m 2H | 19 18 qt 2H J 69 80 | 12 11 t 3H J 80 | 11 10 t 3H J 71

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CC(C)(C)OC(=O)C[C@@H](CCCc1ccccc1)C(=O)O

ir: 7 1 1 2 2 1 6 13 3 8 11 5 4 9 9 9 11 4 23 34 22 48 25 3 2 4 4 1 2 10 30 16 3 2 5 2 6 5 12 4 73 5 2 4 2 2 2 2 3 1 2 2 2 1 1 1 2 2 1 1 2 2 3 3 2 3 4 2 4 4 2 2 4 4 3 16 2 18 90 52 6 6 3 8 3 2 2 1 3 8 3 1 2 3 5 3 15 12 4 4 2 3 2 4 11 7 6 16 13 3 3 3 2 1 0 2 2 2 6 6 17 15 3 3 5 8 4 8 6 4 12 12 12 5 9 7 2 1 2 4 2 4 17 93 100 15 5 2 2 2 1 3 1 1 1 1 1 0 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 0 0 1 1 1 2 1 1 1 2 3 2 3 3 1 1 3 6 6 3 5 9 19 21 12 71 10 5 1 2 1 2 1 1 1 20 2 0 1 1 0 0 1 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 73 72 m 3H | 72 71 ddt 2H J 8 17 77 | 29 28 p 1H J 76 | 28 27 dd 1H J 77 165 | 27 25 tdt 2H J 9 33 82 | 25 24 dd 1H J 77 165 | 19 15 m 5H | 14 14 s 7H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

Cc1cc(Br)nc(C)c1NC(=O)CC(C)(C)C

ir: 1 2 4 2 1 3 3 2 1 3 4 5 1 3 5 4 14 5 7 29 12 10 4 2 1 4 5 12 9 5 5 5 19 17 21 3 2 3 3 1 3 8 7 4 3 4 8 5 3 10 3 1 3 4 4 2 15 3 2 1 5 4 5 5 13 6 4 2 13 10 15 23 3 3 3 2 3 3 1 1 2 3 2 1 3 3 1 2 4 4 2 2 3 3 2 2 3 3 4 3 4 16 5 3 3 3 1 2 4 3 1 3 8 6 2 2 6 5 1 9 8 6 1 3 4 3 3 4 9 5 5 13 4 2 3 4 2 5 5 7 27 100 21 5 4 17 20 8 13 1 11 29 14 2 2 3 3 4 18 3 3 0 1 3 2 0 2 3 2 0 2 4 2 0 2 3 2 0 2 3 2 0 2 3 1 1 2 3 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 3 2 1 1 3 2 1 1 3 2 0 2 3 2 1 2 3 2 0 2 3 2 1 2 3 1 1 2 3 2 1 2 3 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 3 2 1 1 2 2 1 2 5 5 3 2 4 3 2 3 4 2 2 3 4 4 21 13 7 5 19 3 4 2 1 3 4 2 1 2 4 2 1 2 3 2 1 4 4 2 3 8 14 40 33 17 5 5 5 3 4 2 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 3 2 1 2 3; 1HNMR: 91 90 s 1H | 72 72 s 1H | 25 24 s 3H | 24 24 s 2H | 24 24 s 3H | 10 10 s 9H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CCOC(=O)C=C(C)C=CC=C(C)CCC=C(C)CCC=C(C)C

ir: 2 10 8 8 3 8 8 7 16 31 23 12 4 12 8 7 6 4 8 4 2 2 7 4 4 1 2 0 1 2 2 1 0 4 9 3 2 7 3 1 1 1 3 1 1 2 2 3 2 3 1 1 2 1 2 4 2 3 6 10 7 7 17 5 5 10 9 7 15 9 17 16 9 22 23 45 100 72 39 4 8 4 2 1 3 2 3 2 2 2 0 0 3 4 3 7 9 17 12 5 4 2 0 3 10 8 28 32 14 5 11 14 12 16 4 5 16 20 35 27 14 15 7 10 15 17 21 6 5 6 5 8 11 6 9 7 15 19 9 1 2 3 5 4 2 13 93 50 11 0 3 4 7 2 2 2 3 15 9 49 6 3 1 3 1 1 1 2 2 3 8 3 1 1 1 2 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 2 1 0 1 2 2 1 3 3 8 5 6 7 5 3 6 8 6 8 9 14 21 49 99 99 73 39 20 6 4 6 4 1 3 3 1 1 1 2 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 1 1 1 0 1 1; 1HNMR: 67 66 dq 1H J 12 151 | 66 65 ddq 1H J 9 79 152 | 60 59 ddq 1H J 13 28 79 | 58 58 p 1H J 14 | 51 50 m 2H | 43 42 q 2H J 62 | 22 22 tt 2H J 12 78 | 21 20 m 4H | 21 20 t 3H J 12 | 20 19 tq 2H J 11 73 | 17 16 m 6H | 16 16 dp 6H J 11 32 | 13 12 t 3H J 61

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

O=C(O)c1ccc(-c2nn(C(=O)c3c(Cl)cccc3C3CCCC3)c3cccnc23)c(F)c1

ir: 0 2 5 7 3 11 6 1 0 2 3 1 2 3 8 2 3 16 10 5 4 9 25 17 10 6 7 4 1 3 2 1 3 7 4 11 10 4 3 16 5 5 6 2 5 5 5 11 15 10 3 0 2 5 15 11 4 3 10 2 15 13 6 2 3 2 2 3 10 11 3 1 2 3 1 1 6 15 7 13 16 5 2 3 2 2 4 5 4 2 2 3 2 2 1 5 4 2 1 2 3 2 8 2 2 3 11 4 11 3 1 2 3 3 34 3 6 5 4 8 11 5 3 12 6 7 7 6 3 2 5 5 3 7 1 2 2 3 4 5 11 3 10 12 5 2 3 7 5 7 5 9 4 1 2 19 5 1 2 4 2 0 1 4 2 0 1 2 1 0 1 2 1 0 2 2 2 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 2 2 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 2 1 1 2 2 2 2 5 2 1 1 4 2 4 5 7 11 31 41 9 5 2 4 3 2 6 100 88 6 1 3 2 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 1 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2; 1HNMR: 88 87 dd 1H J 20 37 | 82 81 dd 1H J 22 73 | 80 79 m 2H | 79 79 m 1H | 76 75 m 2H | 74 74 m 1H | 73 73 dt 1H J 11 85 | 29 29 pd 1H J 7 50 | 20 19 m 2H | 18 16 m 6H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C#N

ir: 12 1 1 4 7 13 0 2 6 2 3 3 43 12 9 6 16 1 1 4 1 1 1 1 1 1 1 3 2 1 1 1 2 4 1 1 1 0 1 4 4 4 3 2 1 1 1 2 17 1 1 2 1 7 5 6 3 3 4 2 11 0 3 2 3 13 3 11 4 2 2 2 1 0 5 7 1 6 100 6 11 2 6 65 8 9 41 13 6 2 2 1 1 1 1 1 1 11 5 18 17 7 0 1 2 1 1 1 1 1 1 2 2 3 2 2 2 2 2 2 1 1 6 15 6 3 1 1 3 7 1 1 1 1 1 1 1 1 1 1 1 2 24 1 1 1 1 1 5 3 2 1 2 1 1 1 1 1 1 1 3 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 34 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 1 1 1 2 2 4 7 3 8 15 21 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 82 81 d 1H J 21 | 78 78 dd 1H J 22 95 | 72 71 d 1H J 96 | 42 42 q 2H J 63 | 32 31 m 4H | 26 25 m 4H | 23 23 s 2H | 15 14 t 3H J 62

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

Cn1ncc(-c2ccc(C(F)(F)F)cc2S(C)(=O)=O)c(O)c1=O

ir: 8 4 1 2 2 4 4 8 17 15 6 9 39 16 37 43 65 6 12 14 9 2 1 14 4 7 7 11 4 2 2 24 3 1 31 1 6 4 1 2 6 1 2 2 2 0 13 11 4 2 2 3 2 2 18 13 5 7 2 2 1 2 1 2 10 27 15 6 10 3 2 3 4 4 2 3 3 2 4 2 3 16 63 12 25 36 24 40 5 7 20 51 91 58 9 4 3 2 24 22 4 4 3 14 46 23 28 9 4 3 9 6 9 16 34 7 0 7 9 5 1 5 5 4 3 2 7 18 4 4 20 7 2 2 2 2 32 2 6 12 2 3 2 1 18 0 0 1 2 10 3 2 2 3 3 7 6 2 2 6 2 1 1 4 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 1 2 1 2 1 2 1 1 2 3 3 7 11 19 8 20 13 25 18 9 3 5 1 4 34 100 10 4 1 1 2 2 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 86 86 s 1H | 83 83 m 2H | 81 80 m 1H | 79 78 d 1H J 110 | 37 37 s 3H | 32 32 s 3H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CC(=O)c1ccc(-n2c(Cl)cc3[nH]c(=O)c(C#N)c(O)c32)cc1

ir: 42 33 8 6 4 3 2 3 3 2 2 3 4 4 1 4 4 8 3 4 4 5 4 8 11 6 25 10 4 2 2 3 2 13 16 3 2 2 6 4 11 7 4 5 4 2 4 4 3 7 31 83 8 10 13 31 5 1 3 5 3 1 13 18 3 0 2 3 2 6 8 8 2 3 9 31 5 3 2 3 2 8 4 4 1 2 4 4 7 6 100 38 8 7 45 3 2 2 4 3 1 1 3 2 5 3 2 4 11 3 12 3 17 2 3 2 1 4 3 3 2 3 1 5 13 15 19 3 1 3 4 7 1 2 3 2 1 3 20 4 8 36 7 4 9 3 2 2 2 6 16 53 1 5 5 5 2 3 2 0 2 10 38 5 3 2 2 1 1 2 1 0 1 2 1 0 1 2 1 0 2 4 39 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 2 2 2 2 1 1 2 2 1 2 2 2 1 4 5 14 9 13 21 15 11 5 4 3 3 48 48 18 3 2 3 2 1 3 2 1 1 2 2 4 11 6 6 45 18 4 3 1 1 5 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 2 1 1 3 2 1 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1; 1HNMR: 79 79 m 3H | 77 77 m 3H | 60 60 s 1H | 26 26 s 3H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COC(=O)Cc1ccccc1OCc1cc(Cl)cc(C(Nc2ccccc2)C(F)(F)F)c1

ir: 2 1 2 1 4 4 7 11 3 4 2 1 2 3 12 4 5 3 2 1 3 4 3 1 1 1 2 3 1 1 7 1 1 1 9 1 1 1 2 1 2 34 6 17 2 2 3 1 5 1 1 0 1 1 1 0 0 0 0 0 1 1 6 2 4 22 3 7 3 4 2 0 1 1 1 1 1 0 1 1 3 1 2 1 1 0 1 0 1 4 1 4 3 5 2 1 1 1 1 5 6 2 3 2 2 8 1 1 0 0 0 0 1 1 4 3 7 4 3 4 3 2 2 1 1 1 1 3 2 2 0 1 0 0 5 1 2 4 1 1 1 1 11 5 10 9 14 4 6 1 2 2 2 4 3 1 0 0 13 1 1 9 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 2 1 3 4 5 13 100 14 5 4 2 2 3 1 1 1 1 0 0 0 1 0 0 1 1 1 1 1 1 7 23 10 2 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 74 74 m 2H | 74 73 tt 1H J 8 20 | 73 73 ddt 1H J 8 18 77 | 73 72 td 1H J 18 78 | 72 71 td 1H J 12 76 | 71 70 m 2H | 69 69 dd 1H J 12 79 | 68 68 tt 1H J 12 70 | 67 66 m 2H | 60 59 d 1H J 101 | 55 54 m 1H | 51 50 d 2H J 9 | 37 36 s 2H | 36 36 d 2H J 7

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COCCCOc1cc2c(cc1Cl)C=NC(C1CCOCC1)C2

ir: 2 1 11 9 5 2 1 5 2 7 26 2 0 1 3 2 2 3 1 1 1 1 2 1 3 2 1 1 1 1 1 0 1 1 9 10 3 8 1 7 2 1 7 9 1 3 1 1 1 4 4 1 3 12 6 3 5 1 1 2 2 4 2 2 9 35 10 16 17 25 19 9 4 4 10 18 1 4 36 40 8 2 1 0 1 0 0 0 0 1 3 2 3 8 8 4 8 12 34 5 4 3 3 16 7 6 0 2 4 5 5 6 14 8 13 14 13 4 4 3 7 9 12 7 6 4 5 3 5 7 18 1 1 0 1 1 1 0 2 11 2 0 0 0 1 1 8 25 38 3 1 1 1 0 2 9 1 0 0 0 0 0 1 71 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 1 2 1 1 1 2 3 4 7 5 7 4 5 8 4 4 18 30 17 32 100 16 6 2 2 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 84 83 d 1H J 20 | 75 74 s 1H | 68 68 t 1H J 9 | 42 41 t 2H J 63 | 38 37 ddd 2H J 29 55 110 | 36 36 qd 1H J 17 75 | 36 35 m 4H | 33 33 s 2H | 31 30 ddd 1H J 9 75 132 | 28 27 ddd 1H J 7 73 132 | 21 20 p 2H J 63 | 19 18 dtd 2H J 29 57 134 | 17 16 m 3H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COC(=O)CC(c1ccc(C#N)cc1)n1cncc1CO

ir: 3 3 3 5 3 2 4 4 13 9 9 2 3 11 13 6 2 3 3 2 1 2 1 1 1 5 2 1 2 7 3 2 1 2 2 1 3 13 15 15 13 11 17 14 4 3 5 5 4 5 4 3 2 8 7 22 34 7 11 4 1 2 3 5 6 3 2 2 3 24 12 9 7 5 7 7 4 2 2 1 2 1 4 9 14 16 21 15 5 5 4 4 4 13 15 18 5 7 8 6 7 6 4 5 6 5 11 11 9 6 5 5 5 2 1 2 6 5 5 16 6 12 20 19 16 8 8 9 5 3 2 2 3 2 2 5 2 1 3 1 3 6 16 9 7 17 42 9 2 2 1 1 3 1 1 1 1 1 1 1 1 0 0 1 1 0 1 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 0 1 0 0 1 1 1 0 1 1 0 0 1 0 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 1 0 0 1 1 0 1 1 1 1 1 1 1 0 0 1 1 1 1 0 1 1 0 1 1 1 1 1 2 1 6 2 3 3 2 6 4 5 6 9 3 8 9 11 17 38 16 26 57 28 100 24 6 5 5 7 12 10 3 1 0 1 2 0 0 1 1 0 0 1 1 1 0 1 1 0 1 1 1 1 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 76 75 m 3H | 75 74 m 2H | 69 68 dt 1H J 8 17 | 57 56 tt 1H J 9 64 | 48 47 m 2H | 37 36 s 2H | 36 35 t 1H J 58 | 31 31 dd 1H J 64 163 | 29 28 dd 1H J 65 162

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

C=C(C)C(=O)OCCN(CCOC(N)=O)C(=O)C(=O)O

ir: 1 2 0 1 1 1 1 1 1 1 3 8 5 2 2 1 1 6 15 11 5 17 6 3 2 1 0 1 0 0 0 0 1 1 1 2 1 2 5 6 14 4 1 1 0 1 1 1 1 1 0 0 0 1 1 1 0 0 0 0 1 1 1 1 1 1 1 1 1 1 0 1 0 1 4 2 4 2 2 2 5 0 1 1 0 1 1 1 0 0 1 1 10 4 4 2 3 1 1 1 1 1 1 1 1 1 0 0 1 0 1 1 1 1 1 1 4 4 1 0 0 1 2 6 3 1 1 1 0 1 0 1 1 1 2 2 2 2 2 2 5 2 1 1 2 4 7 9 2 1 1 0 0 1 1 0 7 14 21 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 1 1 2 0 1 1 1 2 0 0 0 0 2 1 1 0 1 100 10 2 1 0 0 0 1 2 5 0 0 0 0 0 1 0 0 1 1 2 23 7 6 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 100 99 s 1H | 59 58 dq 1H J 8 16 | 56 56 dt 1H J 15 28 | 49 49 s 2H | 44 43 dt 4H J 64 142 | 37 37 t 2H J 65 | 37 36 t 2H J 64 | 20 19 t 3H J 11

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CC(C)(C)CN(CCOc1ccc(S(N)(=O)=O)cc1)c1ccc(C#N)c(C(F)(F)F)c1

ir: 10 11 13 3 5 1 1 2 2 2 3 7 20 17 4 8 2 2 4 3 1 1 1 2 11 2 2 1 1 2 2 0 2 2 1 0 1 1 3 1 0 1 2 0 1 2 2 1 1 1 2 0 2 6 13 6 5 2 1 1 1 4 7 5 3 2 3 4 8 4 2 5 3 2 6 4 3 5 4 9 4 10 23 10 11 37 14 16 21 18 5 6 3 2 1 3 4 3 3 30 3 2 2 1 1 2 3 3 1 1 1 1 3 2 0 2 8 5 7 27 29 6 8 3 8 9 5 4 2 1 2 1 1 1 1 1 1 1 1 1 1 2 9 2 1 2 4 5 2 2 8 1 3 4 1 3 1 1 1 1 1 3 1 1 4 1 1 1 0 1 0 1 0 0 0 0 0 0 0 1 0 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 1 1 1 0 1 1 1 0 0 0 2 2 3 6 7 13 36 11 7 4 1 1 2 1 1 1 1 0 0 1 1 0 1 2 9 34 3 0 0 12 100 19 3 1 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 78 78 d 1H J 74 | 78 77 m 2H | 73 72 s 2H | 71 71 dq 1H J 9 20 | 71 70 m 2H | 68 68 dd 1H J 22 73 | 42 41 t 2H J 55 | 36 36 t 2H J 55 | 32 31 s 2H | 10 9 s 8H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CC(C)(C)OC(=O)N(Cc1ccc(Cl)cc1)n1cccc1

ir: 3 9 6 5 1 3 3 4 3 6 26 5 5 2 2 14 4 2 2 2 1 1 2 2 2 4 3 13 3 2 4 3 3 3 7 14 98 30 38 17 2 0 2 3 2 2 3 2 2 3 2 3 4 9 13 29 38 9 1 5 2 6 4 2 2 1 2 4 4 2 1 2 1 1 2 32 1 1 1 2 4 7 4 3 1 1 4 2 18 3 2 2 2 7 25 4 3 4 3 3 2 2 1 1 1 1 1 3 7 6 15 5 2 3 1 2 1 2 5 5 6 4 3 9 12 2 2 4 15 11 12 13 5 4 5 2 2 2 2 3 2 1 1 2 7 30 57 31 5 9 15 100 11 13 11 4 3 2 2 2 2 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 2 2 3 2 2 1 2 2 1 1 2 2 4 4 7 26 18 40 27 16 10 35 30 25 10 4 3 2 2 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 73 73 qt 5H J 12 82 | 72 72 t 2H J 29 | 64 63 m 2H | 49 49 t 2H J 8 | 15 14 s 8H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CCc1cccc(C)c1CNc1nc(C(N)=O)cc2c1nc(C)n2C

ir: 0 10 13 8 7 17 7 9 6 10 8 4 5 5 2 5 3 3 3 3 8 6 41 7 13 8 6 5 6 5 6 2 8 10 9 4 15 3 2 4 3 4 3 4 4 4 41 11 11 1 13 4 5 7 8 2 5 5 5 3 5 4 3 1 2 4 7 1 5 12 6 11 8 15 8 3 2 3 6 7 7 4 4 2 5 4 10 4 5 7 1 1 9 5 4 2 2 2 2 5 1 3 2 2 3 5 7 13 17 10 0 5 10 21 15 28 13 24 24 12 11 12 17 12 8 10 4 13 24 29 8 9 7 8 6 8 3 3 6 13 42 6 3 5 7 8 15 3 4 6 5 6 11 6 36 29 28 11 4 1 2 2 1 1 5 4 1 0 15 1 1 0 1 1 1 0 1 2 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 1 1 1 0 0 0 0 1 1 1 0 1 1 1 1 0 1 1 1 0 1 1 1 3 2 5 8 6 5 8 2 6 7 14 4 15 5 9 12 54 18 35 18 100 24 25 17 9 6 6 3 3 3 2 2 1 2 1 4 5 13 67 20 63 14 12 8 3 1 1 2 1 3 72 30 3 2 1 1 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 1 1 0 0 1 1 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 80 80 s 1H | 76 76 t 1H J 61 | 74 73 s 2H | 71 70 m 1H | 70 70 m 1H | 70 69 dt 1H J 11 78 | 49 48 d 2H J 60 | 38 37 s 3H | 27 26 qd 2H J 8 74 | 25 25 s 3H | 23 22 d 3H J 7 | 12 12 t 3H J 75

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

Oc1cccc(Cc2ccccn2)c1

ir: 3 3 6 4 4 3 4 5 7 7 7 3 3 4 3 3 3 3 2 4 3 3 3 4 7 6 8 6 7 17 11 10 8 7 6 5 9 9 19 22 9 5 4 6 9 7 10 18 15 8 6 4 5 14 11 7 6 5 3 4 3 3 3 13 8 8 11 8 10 20 15 6 3 2 4 5 9 15 10 15 20 11 23 100 10 5 3 3 6 10 7 3 4 3 2 3 3 4 6 4 4 3 2 3 3 4 3 14 13 4 3 3 3 3 3 3 3 3 3 4 4 5 4 4 6 5 7 9 20 14 4 5 7 5 4 12 31 16 7 6 26 10 8 3 4 4 4 8 10 4 4 9 6 19 15 47 11 9 4 5 8 9 3 4 3 2 3 3 3 3 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 2 2 3 3 2 2 3 3 3 3 3 3 3 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 3 3 3 3 2 3 3 2 2 3 3 3 2 3 3 3 2 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 4 4 4 4 5 4 3 3 3 4 8 5 9 15 74 59 9 8 6 5 0 56 21 34 7 4 3 3 3 3 3 3 3 3 2 3 3 2 2 3 3 3 3 3 3 2 3 3 3 3 3 3 3 2 3 3 3 3 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3; 1HNMR: 85 85 dd 1H J 17 41 | 76 75 td 1H J 17 73 | 72 71 m 4H | 68 67 s 1H | 67 67 tt 1H J 9 20 | 67 67 dt 1H J 18 78 | 42 41 q 2H J 9

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CCOC(=O)c1c(-c2ccc(Cl)cc2)n(CC)c(C)cc1=O

ir: 16 15 3 10 17 11 5 14 16 10 29 17 22 15 6 15 28 8 3 10 11 6 11 12 11 3 4 24 11 4 7 48 23 4 5 14 11 5 7 14 11 5 9 100 25 2 11 15 14 16 25 24 12 5 9 23 33 14 11 19 18 4 9 17 17 13 11 21 21 18 38 33 13 10 16 20 21 6 10 13 4 4 10 12 5 6 11 12 13 8 20 36 8 6 14 9 4 5 11 9 2 5 12 10 5 7 13 8 0 8 19 8 4 10 23 11 2 9 16 8 3 19 32 17 6 9 13 8 7 12 13 7 4 14 16 6 5 10 12 7 11 35 13 6 8 65 73 34 100 18 13 15 71 43 11 2 7 12 11 3 7 46 16 11 10 13 7 0 6 13 7 0 7 13 6 0 7 12 6 1 8 12 5 1 8 11 5 2 8 11 4 3 9 10 4 3 9 10 4 3 10 9 3 4 10 9 3 4 10 8 2 5 11 8 2 5 11 8 2 6 11 7 1 6 12 7 1 6 12 6 1 7 12 6 1 7 11 6 2 8 11 5 2 8 11 5 3 8 10 4 3 9 10 4 4 9 9 4 4 10 9 3 4 10 9 4 5 11 9 5 9 12 8 2 5 12 8 4 7 13 9 4 14 20 21 16 42 83 49 59 16 16 11 7 9 13 7 3 8 11 5 3 8 10 5 3 9 10 5 3 9 9 4 4 9 9 4 4 9 9 3 5 10 8 3 5 10 8 3 5 10 7 3 6 11 7 2 6 11 7 2 6 11 6 2 7 11 6 2 7 10 6 3 7 10 5 3 8 10 5 3 8 9 5 4 8 9 4 4 9 9 4 4 9 8 4 5 9 8 4 5 9 8 3 5 10 7 3 6 10 7 3 6 10 7 3 6 10 7 2; 1HNMR: 76 75 m 2H | 74 73 m 2H | 62 61 q 1H J 14 | 43 42 q 2H J 71 | 41 41 q 2H J 75 | 25 24 d 3H J 13 | 13 12 td 6H J 52 72

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

Nc1cc([C@H]2CCCN2C(=O)OCc2ccccc2)nn1CC(F)(F)F

ir: 10 14 29 31 6 28 33 23 10 9 10 26 23 17 49 14 17 8 8 5 7 26 9 7 11 6 6 5 6 8 10 16 10 8 8 5 14 8 8 0 43 6 8 10 10 5 7 5 7 6 5 8 5 4 5 6 4 5 6 7 5 4 5 9 8 5 7 14 8 9 11 8 14 18 12 5 6 25 9 5 4 4 5 5 5 13 9 7 11 9 8 8 7 5 5 6 5 8 9 7 5 18 7 7 9 22 17 12 12 37 27 6 5 5 9 7 4 6 7 6 10 8 10 13 7 10 10 10 6 9 19 14 8 9 29 11 7 6 5 4 5 10 16 12 8 5 7 4 5 8 20 43 9 36 11 6 5 4 6 7 19 100 10 5 5 5 5 4 4 5 4 3 4 5 4 4 4 5 4 4 4 4 4 4 4 5 4 4 5 5 4 4 4 5 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 5 4 4 4 4 4 4 4 4 4 4 4 4 4 4 5 4 5 6 7 6 6 6 5 9 7 7 12 19 11 15 27 22 33 15 10 6 5 5 5 5 5 4 4 4 4 5 4 5 9 55 9 4 4 5 5 4 4 4 5 5 52 46 7 4 5 5 5 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 3 4 5 4 4 4 4 4 4 4 5 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4; 1HNMR: 74 73 m 5H | 54 53 s 1H | 52 52 s 2H | 51 51 s 2H | 51 50 d 1H J 119 | 50 50 d 1H J 119 | 48 48 m 1H | 37 37 m 1H | 36 35 m 1H | 23 21 m 3H | 20 19 m 1H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CN(O)C(=O)c1cc2ccn(Cc3ccc(F)cc3)c2cn1

ir: 15 16 0 13 29 17 15 28 28 15 7 38 11 8 12 10 25 17 12 21 36 40 9 14 17 11 10 12 11 5 8 12 10 10 19 31 13 13 10 13 13 13 9 13 10 5 9 16 15 24 12 16 16 8 20 95 97 8 9 13 9 9 18 14 8 6 12 22 34 15 9 11 7 7 10 11 6 5 9 10 5 5 9 10 5 13 20 13 8 6 19 21 28 43 73 27 51 25 12 15 17 48 33 19 10 11 38 29 27 25 19 15 7 8 13 8 5 11 16 8 4 15 19 21 13 9 12 9 6 13 29 26 10 11 97 5 4 9 10 7 12 11 11 6 5 12 15 79 39 24 19 12 23 12 10 9 7 10 8 3 7 16 8 36 10 8 7 5 7 9 7 4 7 9 7 4 7 10 6 4 7 9 6 4 7 9 6 4 8 9 6 5 8 9 5 5 8 8 5 5 8 8 5 5 9 8 5 6 9 8 5 6 9 7 5 6 9 7 4 6 9 7 4 6 9 7 4 7 10 7 4 7 10 7 4 7 10 6 4 8 9 7 5 8 9 6 5 8 9 6 5 8 9 6 6 8 8 6 6 9 8 5 6 9 8 6 6 9 8 5 6 9 8 5 7 14 9 5 8 10 8 8 11 17 22 16 28 39 61 45 36 61 41 37 100 25 10 8 10 10 7 5 8 9 6 5 8 9 6 6 8 8 5 5 8 8 6 6 8 8 6 6 9 8 5 6 9 7 5 6 9 7 5 6 9 7 4 7 9 7 4 7 10 7 4 7 9 7 4 7 9 6 5 7 9 6 5 7 8 6 5 7 8 6 5 8 8 6 5 8 8 5 6 8 8 5 6 8 8 5 6 8 7 5 6 8 7 5 6 9 7 5 6 9 7 5 7 9 7 4; 1HNMR: 91 91 s 1H | 85 85 s 1H | 84 83 d 1H J 25 | 75 74 ddt 2H J 9 35 75 | 73 72 dq 1H J 7 50 | 71 70 m 2H | 65 65 dd 1H J 22 49 | 54 54 q 2H J 9 | 34 34 s 3H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CCOC(=O)C(C)c1ccc(C#N)c(C)c1

ir: 6 4 1 5 5 3 7 3 9 4 6 4 5 3 2 3 3 2 1 2 3 1 2 3 3 4 8 5 6 14 21 4 4 7 2 3 2 1 4 4 6 1 2 3 3 1 1 3 2 1 2 3 2 0 3 5 24 5 3 4 2 1 2 5 4 4 3 4 4 3 3 5 5 2 5 10 5 1 2 3 1 1 3 3 4 29 7 2 2 2 2 2 3 4 10 22 6 6 6 3 2 2 3 2 1 2 2 2 2 3 7 6 6 6 4 6 3 6 5 7 12 9 7 4 2 3 7 4 3 4 7 5 4 4 3 2 1 2 2 2 3 9 9 5 17 8 5 3 5 13 14 1 3 7 3 2 2 3 2 1 2 4 2 1 2 2 2 1 1 2 2 1 1 2 1 1 2 2 1 1 2 2 3 2 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 2 8 4 3 2 2 3 3 2 3 3 15 4 4 19 13 11 22 100 17 9 4 5 2 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1; 1HNMR: 76 76 d 1H J 83 | 74 73 m 1H | 73 73 t 1H J 14 | 42 41 qd 2H J 34 63 | 38 37 m 1H | 24 24 s 2H | 15 14 d 3H J 75 | 12 12 t 3H J 63

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COCCNC(=O)CN1C[C@@H]2COCCN2c2nc(Cl)ncc21

ir: 4 6 6 4 3 3 3 7 12 11 10 4 4 3 6 5 6 4 17 14 41 8 7 7 9 8 8 9 7 10 7 9 7 6 10 18 29 3 6 16 68 42 11 20 4 3 5 7 4 4 5 11 6 10 16 6 6 3 2 5 3 2 4 8 4 10 6 5 4 4 5 11 11 26 6 49 3 2 3 4 2 3 12 3 4 2 5 6 2 4 8 5 2 2 5 4 3 6 4 10 5 7 3 4 4 7 13 16 3 3 5 9 8 24 12 9 5 14 15 15 29 19 12 13 20 12 20 6 9 8 7 12 4 5 5 6 67 13 4 6 5 2 21 52 34 100 22 36 10 5 7 0 82 4 4 2 2 3 3 3 30 6 3 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 2 3 5 4 5 5 2 2 5 2 3 8 7 17 4 6 3 3 2 2 2 2 1 2 2 2 1 2 2 2 2 3 3 7 4 4 6 5 21 29 45 68 21 7 6 5 4 3 3 2 2 2 2 1 1 2 2 1 2 2 2 1 2 4 2 2 2 2 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 1 2 2 1; 1HNMR: 78 78 s 1H | 71 71 t 1H J 51 | 43 42 m 2H | 42 41 dd 1H J 37 110 | 40 40 dd 1H J 33 103 | 39 37 m 7H | 35 34 t 2H J 46 | 34 33 m 6H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CC(C)[C@@]1(CC(C)(C)O)CCN([C@@H](C)c2ccc(-c3cnc(C(=O)O)nc3)cc2)C(=O)O1

ir: 5 12 4 3 5 4 7 11 4 8 8 12 7 7 9 13 11 40 39 54 70 62 18 2 5 3 7 5 9 15 6 2 1 2 2 1 4 10 21 23 5 6 5 3 4 3 2 1 1 2 1 1 2 7 4 1 6 17 14 8 6 5 4 7 5 2 2 1 5 6 3 4 4 9 6 12 15 22 32 15 24 16 6 6 4 10 5 6 7 6 2 4 2 5 5 4 5 4 6 10 5 4 2 3 16 12 32 5 6 10 5 7 9 3 6 3 2 7 15 7 13 13 17 13 12 20 37 7 14 9 4 5 6 3 3 6 7 12 10 70 16 8 4 2 2 1 1 5 6 4 100 6 3 7 3 0 1 3 33 9 1 1 1 1 13 0 2 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 3 2 3 2 2 1 2 3 3 3 4 9 5 18 13 14 9 34 14 3 5 3 2 3 9 25 18 26 7 2 1 1 1 1 1 1 2 1 2 4 2 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 93 93 s 2H | 77 76 m 2H | 74 73 m 2H | 49 48 m 1H | 36 35 m 2H | 34 33 s 1H | 21 21 ddd 1H J 35 55 132 | 21 20 m 2H | 19 18 ddd 1H J 34 54 130 | 18 17 d 1H J 143 | 15 14 d 3H J 71 | 13 13 s 2H | 12 12 s 2H | 10 9 dd 6H J 68 214

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CNC(=NS(C)(=O)=O)NCCCCc1nc(NC(N)=NCC(F)(F)F)sc1C

ir: 5 7 10 19 32 17 17 15 9 12 12 13 23 15 11 13 18 6 13 10 11 10 9 20 9 18 9 16 8 8 7 4 10 8 16 12 9 14 7 3 6 15 7 6 6 9 3 4 7 4 5 5 5 5 11 18 5 3 38 6 9 10 7 1 4 5 4 5 15 25 53 42 43 22 19 17 4 3 4 2 2 4 3 2 15 50 12 5 8 27 12 45 24 16 14 15 11 10 7 12 15 48 14 13 19 28 13 4 4 8 10 19 4 9 2 8 8 12 10 11 43 15 20 10 10 5 12 11 8 7 13 4 6 10 16 14 29 17 20 24 22 34 57 42 28 68 34 8 20 26 27 62 19 6 15 100 65 19 7 3 2 2 2 2 2 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 3 2 6 3 5 3 3 2 4 3 10 16 13 6 5 5 4 2 2 1 1 2 1 3 2 1 3 3 2 2 5 6 6 12 17 9 8 17 22 17 25 24 91 62 42 22 25 2 5 4 0 2 3 2 0 1 3 2 0 1 2 2 0 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 83 82 s 1H | 71 70 s 2H | 67 66 t 1H J 39 | 53 53 q 1H J 42 | 41 40 q 2H J 119 | 33 33 td 2H J 39 49 | 32 32 s 2H | 29 29 d 3H J 44 | 27 26 t 2H J 73 | 23 23 s 2H | 18 17 m 2H | 17 16 m 2H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

c1cnn(CC2CCNCC2)c1

ir: 9 9 2 4 6 9 10 31 24 32 15 6 3 2 1 2 3 1 1 2 3 3 8 7 13 12 6 13 8 9 8 9 7 4 7 7 10 31 32 58 75 35 18 8 4 7 15 16 24 65 65 48 36 11 28 39 39 24 43 11 9 4 9 4 10 13 43 4 28 17 7 6 3 2 3 2 3 2 4 3 1 1 2 2 2 1 1 2 5 22 11 22 18 10 9 7 4 2 6 2 3 2 2 4 13 16 11 10 7 40 24 67 99 36 48 24 11 21 9 15 14 6 11 8 15 20 27 13 27 19 24 15 17 8 4 5 2 5 3 4 22 29 62 20 8 4 2 3 6 14 12 18 11 6 5 1 3 3 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 1 1 0 1 2 1 0 1 1 1 0 1 1 0 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 2 1 0 1 1 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 2 1 1 5 3 3 5 6 5 3 8 5 3 8 10 15 5 16 5 11 8 28 42 55 22 21 3 2 2 2 2 2 4 5 6 6 16 76 91 95 100 20 18 4 2 2 3 3 0 0 2 2 0 0 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 1 1 1 1 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 74 74 dq 1H J 8 33 | 73 73 d 1H J 31 | 62 62 t 1H J 32 | 50 49 p 1H J 39 | 38 38 dd 2H J 9 42 | 29 28 dddd 2H J 20 39 46 134 | 28 27 dddd 2H J 18 39 46 134 | 19 18 m 3H | 16 15 dddd 2H J 19 47 65 128

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CC(C)(C)OC(=O)N1CCOc2nc(Cl)ccc2C1

ir: 4 4 3 6 3 3 9 5 4 6 14 11 6 13 6 3 5 2 3 2 2 2 2 3 4 2 2 2 2 3 2 3 9 3 4 15 9 3 11 3 18 28 11 4 5 3 3 2 2 5 4 8 12 3 5 4 3 2 2 2 3 5 5 2 2 2 2 2 3 5 2 2 2 2 2 2 2 3 2 2 2 2 2 2 12 11 4 2 2 2 2 2 3 2 2 2 2 4 2 2 3 3 3 3 3 3 3 2 3 2 2 2 3 4 3 6 6 5 10 8 12 10 24 9 5 3 5 4 4 5 6 4 6 5 33 32 8 6 6 2 3 4 3 2 2 4 4 2 2 7 14 100 7 0 1 3 2 8 4 3 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 3 3 2 3 3 3 3 2 2 3 4 3 11 11 8 4 12 14 5 3 2 2 3 2 2 2 2 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2; 1HNMR: 76 76 dt 1H J 8 81 | 68 68 d 1H J 81 | 46 46 d 2H J 8 | 45 44 t 2H J 72 | 38 37 t 2H J 72 | 15 14 s 8H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COc1ccc(CCNCc2ccc(C(C)(C)C)cc2)cc1

ir: 1 1 3 3 3 2 2 1 2 1 2 3 2 2 11 3 3 5 7 8 5 3 2 1 1 1 1 1 4 2 3 1 2 2 6 7 3 2 4 2 2 10 15 5 6 3 8 20 14 2 2 6 6 7 33 22 22 7 16 18 5 3 10 5 4 0 8 5 8 11 4 3 2 2 1 1 2 1 1 1 1 1 1 1 1 1 2 5 3 2 1 4 10 3 3 2 2 3 6 6 6 2 1 1 1 1 3 2 8 3 24 20 15 16 3 14 6 6 2 3 5 5 3 4 3 6 5 6 4 7 6 5 6 9 12 5 4 1 1 2 1 1 1 1 2 2 3 12 26 23 20 10 11 10 3 2 2 2 1 1 1 3 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 2 3 2 1 2 2 2 2 3 13 13 6 21 69 17 9 4 4 3 2 2 3 1 0 2 2 1 0 3 7 2 1 100 73 23 9 1 3 5 2 0 0 2 2 0 0 1 1 0 1 1 1 1 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 73 73 m 2H | 72 71 dt 2H J 9 75 | 70 70 dq 2H J 9 86 | 69 68 m 2H | 39 39 dt 2H J 9 53 | 38 38 s 3H | 33 32 q 2H J 51 | 32 31 p 1H J 52 | 29 29 tt 2H J 9 51 | 14 13 s 8H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CC(=O)N(c1ccc(Cl)cc1)[C@@H]1C[C@H](C)N(C(=O)c2ccc3c(c2)NCCO3)c2ccccc21

ir: 0 4 4 1 11 2 5 6 10 6 3 2 3 3 3 4 10 3 3 2 4 3 3 7 1 2 2 6 3 2 1 7 14 3 3 2 4 4 3 5 4 8 6 100 13 4 3 2 4 3 4 8 7 0 11 53 16 6 2 0 3 3 4 2 4 3 5 2 4 5 17 8 4 3 3 2 3 4 2 1 2 2 1 1 3 4 9 3 3 4 9 5 2 2 1 1 2 2 3 4 9 3 27 3 4 3 1 2 6 3 2 6 4 7 3 17 7 4 15 12 10 6 12 12 7 5 6 5 11 19 21 12 16 5 4 2 4 9 15 23 21 7 7 5 6 6 15 5 9 59 40 30 5 2 3 13 4 1 2 3 8 0 3 2 2 1 2 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 3 3 1 2 3 3 1 3 3 3 3 3 3 6 3 28 11 79 66 37 6 5 3 5 6 4 2 2 2 1 1 2 2 2 1 2 2 3 2 4 6 7 17 65 11 4 4 3 1 2 2 1 1 2 2 2 2 1 1 1 1 2 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 76 76 dd 1H J 22 90 | 75 74 ddd 1H J 7 14 85 | 73 72 m 7H | 72 72 dd 1H J 15 81 | 71 71 ddd 1H J 15 79 86 | 70 70 d 1H J 89 | 59 58 dddd 1H J 7 26 51 78 | 53 53 t 1H J 40 | 46 45 dddq 1H J 27 54 79 104 | 43 42 m 2H | 36 35 m 2H | 23 22 m 3H | 20 19 dt 1H J 78 123 | 13 13 d 3H J 80

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CCCCCCC(CC(=O)OCC)C(=O)CCC

ir: 12 15 10 10 11 7 4 11 14 7 11 8 9 9 8 7 10 4 4 8 12 10 4 10 8 7 11 23 24 18 8 8 7 3 4 7 8 6 10 13 13 11 8 12 8 0 8 13 9 4 7 14 6 3 7 8 10 5 4 7 5 1 6 13 9 3 5 8 5 5 6 8 5 11 14 41 10 2 6 6 3 2 4 5 2 2 5 5 2 2 7 7 5 6 17 11 8 8 22 9 11 25 43 45 49 51 37 33 19 25 19 20 23 34 37 16 16 18 40 31 17 34 64 29 12 9 15 11 18 13 17 9 6 16 17 26 19 10 12 10 18 48 99 61 81 100 17 15 7 7 5 3 3 6 4 1 3 5 4 1 3 6 4 1 3 6 3 1 3 6 3 0 3 6 3 0 3 6 3 1 3 5 2 1 4 5 2 1 4 5 2 1 4 5 2 1 4 4 2 2 4 4 1 2 5 4 1 2 5 4 1 2 5 4 1 2 5 3 1 3 5 3 1 3 5 3 1 3 6 3 1 3 5 3 1 3 5 3 1 4 5 3 1 4 5 2 2 4 5 2 2 4 5 2 2 5 4 3 3 5 5 3 3 6 5 2 4 6 7 8 7 16 16 20 20 23 15 9 10 29 21 20 26 57 48 55 15 12 5 5 4 6 4 2 4 5 3 1 4 4 3 2 4 4 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 3 1 2 5 3 1 3 5 3 1 3 5 3 1 3 5 3 1 3 5 3 1 3 5 3 1 3 4 2 1 3 4 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 3 2 2 4 3 1 3 4 3 1 3 5 3 1 3 5 3 1; 1HNMR: 41 41 q 2H J 66 | 29 28 tt 1H J 74 84 | 27 26 dd 1H J 83 165 | 25 24 m 2H | 23 22 dt 1H J 68 148 | 18 17 dtd 1H J 74 85 135 | 16 15 m 3H | 15 14 m 1H | 14 12 m 10H | 9 8 td 6H J 58 74

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CCC(=O)Nc1nc(-c2ccc(OC)cc2)c(CCN=[N+]=[N-])s1

ir: 4 5 6 4 4 5 5 5 5 7 7 5 8 6 13 6 4 7 7 8 6 11 7 14 6 11 8 18 8 11 11 16 16 9 22 9 8 36 24 14 11 6 8 7 9 11 11 9 14 13 9 7 7 12 13 44 25 0 8 9 8 14 10 12 8 8 7 6 5 17 6 15 9 6 8 5 7 4 4 4 5 6 6 6 5 8 4 8 11 18 5 4 6 5 5 5 7 7 5 10 9 7 6 7 6 5 5 14 13 4 4 6 6 5 4 7 9 8 6 8 5 7 5 8 6 8 4 5 5 4 7 6 6 4 4 5 5 3 3 5 6 3 7 11 21 57 29 77 98 30 28 8 17 12 7 4 4 5 4 4 4 4 4 4 4 4 4 4 4 4 4 3 4 4 4 4 4 4 4 4 4 3 4 4 3 3 4 4 4 3 4 4 3 3 4 4 3 4 4 4 3 3 4 4 4 5 11 9 7 4 4 4 4 4 4 4 3 3 4 4 3 4 4 4 3 4 4 4 3 4 4 4 4 4 4 4 3 4 4 4 4 4 4 4 3 4 4 4 4 4 4 3 3 4 4 3 4 4 4 3 3 4 4 4 4 4 4 4 4 5 4 4 5 5 6 5 6 5 5 5 5 8 10 9 21 11 28 100 21 8 8 6 8 5 4 5 4 4 4 5 4 4 4 4 5 4 5 10 8 11 98 74 12 22 12 5 5 5 3 3 4 4 4 4 4 4 3 3 4 4 3 3 4 4 3 4 4 4 3 4 4 4 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 3 4 4; 1HNMR: 90 89 s 1H | 76 75 m 2H | 69 68 m 2H | 38 38 s 3H | 37 37 t 2H J 58 | 34 33 t 2H J 58 | 25 24 q 2H J 71 | 12 11 t 3H J 71

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CNCC(O)c1ccc[n+]([O-])c1

ir: 1 3 6 6 2 7 10 9 6 5 5 3 2 6 7 4 1 2 5 1 1 3 3 11 22 8 6 5 7 8 5 3 3 3 2 1 2 3 4 3 9 18 25 10 15 16 4 4 4 4 7 13 49 13 4 3 4 6 3 5 4 3 5 6 4 5 2 4 2 2 2 3 3 3 5 6 5 8 7 7 5 3 3 3 4 7 18 44 16 13 27 16 4 3 2 1 4 4 1 1 3 2 0 1 2 2 0 2 4 3 2 4 5 21 30 21 28 33 14 5 5 2 2 4 10 3 2 3 15 3 2 2 3 3 7 4 4 2 1 3 44 13 1 2 1 1 2 2 3 14 2 4 2 1 1 6 4 0 1 2 2 2 9 3 3 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 0 1 2 1 1 2 2 0 1 2 2 0 1 2 2 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 3 1 1 3 2 2 4 3 3 3 3 2 2 1 2 3 3 14 19 30 41 19 16 6 1 0 4 7 45 100 37 2 2 3 2 3 2 3 6 5 26 37 62 5 5 3 8 2 3 2 2 2 2 2 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2; 1HNMR: 50 49 tq 1H J 47 62 | 48 48 d 1H J 42 | 48 47 q 1H J 37 | 43 43 d 1H J 17 | 41 41 dd 1H J 16 58 | 35 34 dd 1H J 57 67 | 32 31 dt 1H J 15 64 | 31 30 ddd 1H J 36 63 129 | 28 28 ddd 1H J 35 62 128 | 27 26 d 3H J 48

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COc1cc(C2CC(=O)c3ccc4ccccc4c3O2)cc(OC)c1OC

ir: 1 1 3 2 2 1 1 1 2 2 2 1 1 1 1 2 3 5 2 1 1 1 1 2 2 2 3 2 1 2 3 4 1 3 13 1 1 1 2 1 2 4 27 11 1 0 1 1 1 1 9 3 1 1 9 20 1 2 1 0 2 2 2 8 4 6 7 24 12 11 3 3 3 2 5 5 1 1 1 9 1 1 1 4 0 0 1 1 1 0 1 4 10 1 1 1 1 1 1 2 1 1 2 2 9 18 9 1 0 2 3 1 1 1 2 1 1 6 8 2 3 9 5 2 1 3 2 4 29 11 15 14 4 3 13 4 2 1 1 3 0 1 1 5 3 1 1 1 20 9 27 5 29 1 1 1 5 4 4 1 1 1 6 2 1 1 2 6 1 0 1 1 0 0 0 1 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 1 0 0 0 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 2 2 1 2 2 1 4 4 12 11 16 100 34 5 3 2 2 0 2 1 1 1 1 1 1 0 1 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 83 82 dd 1H J 15 75 | 80 79 d 1H J 83 | 79 78 m 2H | 76 74 m 2H | 68 67 d 2H J 7 | 55 55 m 1H | 39 38 d 9H J 22 | 32 31 dd 1H J 58 168 | 29 29 dd 1H J 58 168

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COc1ccc(C=O)c(OS(=O)(=O)C(F)(F)F)c1

ir: 3 8 5 6 6 5 10 16 100 12 37 6 2 3 3 2 6 3 2 2 1 2 3 3 6 3 3 2 3 9 6 4 2 4 3 3 2 3 2 1 1 2 2 1 2 3 3 2 2 4 14 4 3 10 24 1 3 5 2 0 25 5 3 4 3 39 31 6 11 12 43 57 6 0 3 4 1 1 2 3 1 2 2 2 5 87 9 5 5 6 3 2 2 2 2 2 3 13 9 3 3 11 8 3 2 2 2 3 28 6 2 2 2 2 2 2 3 2 4 4 5 4 2 3 4 3 6 5 2 2 2 2 2 2 2 3 4 18 3 2 2 2 1 2 2 2 2 2 1 10 5 2 6 20 8 3 10 63 6 3 3 3 9 27 8 1 1 2 2 1 2 2 1 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 3 3 1 2 2 2 1 2 2 2 1 3 2 2 4 5 6 43 33 40 10 3 2 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2; 1HNMR: 79 78 d 1H J 88 | 70 69 d 1H J 23 | 66 65 dd 1H J 24 88 | 38 38 s 3H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

Cc1ccccc1CN1CCC(N)C1

ir: 1 1 2 2 5 2 1 1 0 1 0 0 0 0 1 0 0 0 1 0 0 1 1 0 3 1 1 1 0 0 0 0 0 0 0 0 0 0 1 2 11 6 9 2 1 2 2 1 1 1 1 0 1 2 2 1 3 21 7 4 8 20 5 12 6 9 7 7 4 2 3 2 16 8 33 16 2 5 17 4 7 20 3 1 5 12 2 2 1 11 2 7 5 2 1 1 1 1 1 2 2 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 0 2 3 3 4 3 4 5 3 5 2 5 6 10 17 6 26 65 8 9 4 6 0 2 1 2 1 2 2 1 0 1 2 7 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 2 1 3 2 1 1 1 2 2 3 3 4 3 28 8 4 2 1 1 0 1 0 1 2 4 5 5 14 8 14 10 5 12 2 7 18 100 4 2 7 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 1 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 72 71 m 4H | 37 36 d 1H J 137 | 36 35 dd 1H J 6 137 | 33 33 m 1H | 28 27 m 2H | 26 25 ddd 1H J 46 64 123 | 24 23 s 3H | 23 22 m 1H | 20 19 dddd 1H J 32 48 65 132 | 17 16 d 2H J 53 | 14 13 dddd 1H J 29 47 65 131

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

Nc1ccc(NC(=O)OCC(Cl)(Cl)Cl)cn1

ir: 7 9 7 4 5 3 4 3 2 2 0 1 2 1 2 3 2 3 6 3 2 1 2 3 1 1 4 5 4 3 3 16 9 19 11 6 7 3 3 2 3 3 1 1 1 1 1 1 1 2 1 0 9 11 5 2 3 2 1 1 1 1 1 1 3 8 4 2 1 2 2 2 1 2 2 2 2 0 1 0 0 0 1 1 0 0 1 0 2 1 1 1 1 0 1 4 4 1 1 1 1 1 1 4 8 2 1 1 0 0 0 0 1 1 1 0 1 0 1 1 0 1 1 2 4 4 4 2 1 1 1 0 0 1 2 3 3 3 4 2 1 2 3 38 6 3 3 3 6 33 4 1 9 34 19 14 3 1 1 2 2 3 8 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 1 1 1 1 1 1 1 0 0 1 2 5 6 4 3 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8 19 2 1 2 9 6 4 3 3 6 10 100 98 10 5 1 1 1 0 0 1 0 0 1 1 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 86 86 d 1H J 19 | 84 84 s 1H | 77 77 dd 1H J 18 77 | 66 66 d 1H J 76 | 55 54 s 2H | 49 49 s 2H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CC(C)C(=O)Nc1ccc(-c2ccnc(Nc3ccc(CC(=O)O)cc3)n2)cc1

ir: 0 2 2 2 1 2 4 5 5 5 5 5 7 16 16 4 18 10 7 5 16 45 22 25 13 14 13 5 3 3 3 4 3 5 4 19 35 33 14 4 8 4 3 2 12 24 10 8 10 6 2 0 3 2 4 14 16 21 8 3 2 3 2 1 2 11 1 1 2 5 2 4 5 19 5 2 9 17 14 12 5 3 3 3 1 2 3 3 2 6 4 2 2 3 3 3 6 6 8 6 7 6 5 10 51 10 5 3 2 2 1 1 2 1 1 2 2 3 4 4 2 2 2 3 2 4 3 3 4 2 2 2 2 1 1 12 3 2 3 23 10 9 11 27 9 45 14 24 33 7 9 17 100 96 11 9 6 16 4 3 2 1 1 6 21 0 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 2 2 2 3 2 3 3 7 4 12 78 12 21 2 3 2 3 2 2 8 22 5 2 3 1 1 1 1 3 3 3 4 4 21 26 18 30 3 3 3 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 91 91 s 1H | 90 90 s 1H | 84 83 d 1H J 48 | 78 78 m 2H | 76 75 m 2H | 73 72 m 6H | 34 34 d 2H J 9 | 27 26 p 1H J 65 | 12 11 d 6H J 65

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

C[C@@H](C(=O)N[C@H](C=O)CC(=O)O)N(C(=O)c1cc2ccccc2n1C)c1ccccc1

ir: 3 3 4 3 5 6 4 8 11 6 9 7 27 14 9 13 15 20 39 34 43 56 33 18 13 18 8 11 10 8 11 6 11 16 19 27 13 7 16 14 21 30 42 81 28 22 11 2 13 9 13 11 11 3 2 5 3 7 6 3 2 3 3 3 3 0 3 5 8 11 4 2 4 8 10 17 7 9 28 18 16 11 14 10 9 6 9 6 1 1 2 2 3 2 8 5 13 8 3 4 1 1 5 17 11 8 7 8 12 17 6 9 3 7 3 7 5 8 4 7 10 12 10 5 9 9 6 6 5 38 17 7 3 4 7 20 8 4 5 5 29 25 45 23 52 36 40 51 26 5 10 11 24 5 3 2 2 2 1 3 4 2 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 2 1 4 3 2 1 1 3 3 2 2 7 4 7 4 14 12 5 22 54 89 41 8 7 3 5 5 8 43 74 8 5 2 1 1 1 4 3 3 5 4 5 6 9 19 100 11 6 5 2 2 1 2 1 0 1 1 1 0 0 0 1 0 1 1 0 1 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0; 1HNMR: 97 97 dt 1H J 9 64 | 81 81 d 1H J 92 | 77 77 m 1H | 75 74 ddd 3H J 14 81 193 | 74 73 m 4H | 72 72 td 1H J 17 70 | 71 71 m 1H | 47 46 dtd 1H J 65 74 92 | 46 45 q 1H J 70 | 38 38 s 2H | 28 27 ddd 1H J 8 74 167 | 26 25 ddd 1H J 9 73 168 | 14 14 d 3H J 70

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COc1ccc(Nc2cc3c(cc2Nc2ccc(OC)cc2)C(=O)NC3=O)cc1

ir: 3 3 3 5 2 4 2 6 5 4 4 5 6 5 4 2 2 3 5 3 2 3 6 4 8 2 4 3 6 3 4 7 6 3 5 6 3 12 3 5 6 4 6 7 16 56 9 0 2 3 2 2 2 3 3 28 28 10 2 1 3 4 3 5 3 4 2 3 4 14 4 2 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 5 5 2 1 2 3 2 1 1 2 4 2 2 3 7 2 2 4 10 17 11 3 2 2 1 2 2 1 2 5 3 25 3 2 4 1 2 4 4 1 2 2 2 4 2 2 3 2 3 4 6 30 4 2 2 6 5 2 2 2 11 2 4 25 9 15 20 4 22 8 7 2 3 37 4 8 4 5 1 3 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 2 2 2 2 1 2 3 2 2 4 7 17 17 13 6 3 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 3 2 4 19 100 39 14 4 5 5 3 2 2 2 3 1 1 2 2 2 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2; 1HNMR: 89 88 s 1H | 79 79 s 2H | 77 77 s 2H | 71 70 m 5H | 70 69 m 5H | 38 38 s 5H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

O=C(O)Cc1ccccc1OCc1ccc(F)cc1

ir: 1 1 1 1 1 2 4 3 23 4 7 3 12 10 6 3 1 5 9 12 60 23 22 17 16 3 1 2 2 0 0 2 2 1 1 2 4 2 1 3 3 6 78 8 2 3 6 7 4 3 2 4 9 13 45 5 4 4 2 2 2 2 1 2 1 2 3 1 5 5 3 2 2 1 3 5 10 8 12 15 8 4 3 5 4 7 3 3 4 3 7 7 1 2 1 1 3 2 1 1 1 5 3 8 2 1 1 1 1 1 1 1 1 3 4 2 1 2 3 6 7 2 3 3 4 4 4 1 1 2 2 1 1 1 1 1 2 27 1 3 4 3 7 5 30 20 9 17 9 5 1 1 2 2 2 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 2 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 3 2 1 2 1 1 2 4 4 4 12 35 16 14 3 1 2 3 2 0 97 100 9 8 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 76 75 ddt 2H J 8 35 79 | 73 73 ddt 1H J 9 18 77 | 73 72 ddd 3H J 21 79 97 | 72 71 td 1H J 13 77 | 69 69 dd 1H J 13 79 | 51 51 t 2H J 8 | 36 35 d 2H J 10

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

Fc1cccc(F)c1C1=NC(c2ccc(Cl)cc2)CCO1

ir: 4 2 2 2 3 1 2 1 2 2 2 1 2 2 6 1 2 2 1 1 4 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4 6 100 6 3 3 2 5 23 12 9 3 2 2 1 1 2 1 1 1 1 1 2 3 3 1 1 4 2 2 5 2 1 1 1 1 1 2 2 2 4 1 1 1 1 1 1 5 3 18 2 1 1 1 1 1 1 1 1 2 3 8 3 1 3 4 6 3 1 2 1 4 2 2 1 1 1 1 2 4 3 2 1 2 1 1 1 1 1 5 11 2 5 8 12 7 2 2 3 8 4 3 14 3 2 3 2 9 3 1 3 38 7 3 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 1 1 1 1 2 2 4 5 8 21 54 10 11 7 5 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 75 74 tt 1H J 51 78 | 73 73 s 4H | 72 71 m 2H | 51 50 t 1H J 68 | 44 43 ddd 1H J 38 64 103 | 43 42 ddd 1H J 37 64 102 | 24 23 dtd 1H J 38 66 132 | 22 21 dtd 1H J 37 66 133

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COc1ccc2c(C)c(Cl)nc(Cl)c2c1

ir: 1 1 1 1 2 2 0 4 4 4 2 2 5 2 2 5 12 17 42 17 5 2 3 2 5 3 4 17 56 16 8 8 9 0 1 2 1 2 1 2 1 0 1 2 1 1 1 9 5 0 1 2 5 2 18 100 55 6 4 5 2 2 5 4 7 3 9 25 19 7 3 4 9 6 3 4 2 2 4 3 15 2 3 2 1 1 2 2 1 0 1 2 0 2 3 2 0 1 2 2 3 2 4 3 1 2 23 2 2 2 3 2 1 3 10 12 21 40 17 11 9 4 10 15 11 42 12 9 13 11 8 5 11 21 13 6 3 4 5 4 56 15 8 10 3 3 2 1 2 14 40 70 7 2 5 56 2 7 28 4 2 2 1 1 1 1 1 2 2 1 1 1 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 0 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 2 3 1 2 1 2 3 3 2 1 4 5 5 6 14 14 58 36 60 22 7 10 3 1 3 3 1 0 1 2 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 78 77 d 1H J 81 | 75 75 d 1H J 27 | 69 69 dd 1H J 27 82 | 38 38 s 3H | 27 26 s 3H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COc1ccccc1CCNS(=O)(=O)c1cc(-c2cc3ccccc3[nH]2)ccc1Cl

ir: 4 4 3 5 10 5 5 1 1 4 3 2 4 10 5 1 1 2 1 0 0 0 1 1 1 1 1 3 2 1 1 1 0 2 2 2 4 2 2 2 4 7 21 22 5 8 7 6 6 3 3 5 5 7 19 6 4 5 2 3 1 15 3 1 2 4 7 9 10 12 47 23 7 0 3 4 1 2 1 2 1 4 4 7 2 30 10 1 1 6 3 1 9 2 1 1 4 3 3 9 4 4 39 14 18 12 15 6 10 3 3 2 6 3 1 2 2 2 1 2 1 1 1 1 2 1 3 2 2 4 2 2 2 2 5 14 7 9 11 2 2 2 7 5 5 2 0 1 4 13 1 2 2 1 3 1 15 3 1 1 1 5 1 1 2 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 1 0 1 1 1 0 1 1 2 4 4 6 5 37 27 17 6 3 2 1 1 1 0 0 1 0 1 1 1 1 1 2 2 3 27 100 3 6 6 12 10 4 5 1 1 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 84 84 s 1H | 83 82 dd 1H J 7 15 | 77 76 d 2H J 15 | 75 75 m 1H | 74 74 dd 1H J 14 80 | 73 72 td 1H J 20 73 | 71 70 m 5H | 69 69 m 2H | 64 63 t 1H J 65 | 38 38 s 2H | 34 34 q 2H J 61 | 30 29 td 2H J 8 59

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COc1ccc(N2C(=O)N(Cc3c(F)cc(F)cc3F)c3ccccc3S2(=O)=O)cc1OC

ir: 2 2 4 3 3 4 4 13 6 5 9 5 9 6 4 5 4 3 4 1 2 2 3 5 5 3 3 1 1 2 3 1 1 2 2 4 3 3 5 2 1 3 17 5 37 3 11 4 3 1 4 4 4 40 5 1 2 2 1 1 2 5 7 17 25 40 34 22 4 1 2 1 2 5 7 12 9 2 2 8 3 2 2 8 13 3 29 7 5 4 3 1 1 1 2 2 7 4 1 1 1 1 1 3 2 2 4 4 4 1 3 4 3 1 2 1 2 3 1 2 2 2 1 7 2 3 2 3 4 3 1 2 3 2 17 2 1 3 2 4 3 1 2 10 4 2 2 2 2 10 61 10 29 6 19 7 1 1 1 0 18 1 4 3 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 1 1 1 1 1 1 1 0 1 2 2 2 1 1 2 1 1 2 2 1 6 9 20 100 30 23 5 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 78 77 dd 1H J 14 91 | 76 76 dd 1H J 15 74 | 76 75 m 2H | 74 73 ddd 1H J 14 77 91 | 71 71 d 1H J 21 | 69 69 d 1H J 85 | 68 67 ddd 2H J 9 114 122 | 53 52 t 2H J 48 | 39 39 s 3H | 39 38 s 3H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

COC(=O)c1c2cccccc-2c(Br)c1-c1ccc(SC)cc1

ir: 6 13 3 5 43 18 12 5 1 2 3 3 13 6 10 6 8 6 7 9 4 3 6 11 4 2 2 1 2 2 3 1 0 5 10 2 10 2 2 2 1 2 3 4 4 13 9 64 100 20 6 4 8 16 19 23 27 3 5 9 3 6 5 8 2 2 1 2 5 8 7 1 1 3 6 9 7 4 5 1 1 2 20 1 1 2 4 1 2 3 7 2 3 2 1 1 6 8 3 2 5 3 3 2 13 53 7 1 2 2 5 4 7 6 7 4 4 9 4 6 3 5 18 6 3 2 1 2 1 2 10 3 2 3 6 18 14 22 2 10 4 13 17 35 54 34 12 9 10 4 2 9 5 3 15 36 3 8 2 2 1 1 2 6 3 1 1 2 4 1 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 1 1 1 2 1 1 2 1 2 1 2 3 4 4 5 7 12 10 17 29 82 17 43 30 25 24 9 4 1 1 3 1 0 1 2 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 86 85 dt 1H J 10 83 | 83 82 dd 1H J 9 102 | 78 78 m 2H | 76 75 ddt 1H J 9 92 105 | 75 74 m 2H | 74 73 m 2H | 41 41 s 3H | 25 25 s 3H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

Cc1cc(C2CC3CC2CC3CCOCCC2CC3CC2CC3c2ccc(O)c(C)c2)ccc1O

ir: 5 2 2 2 8 5 4 6 2 3 2 4 3 4 3 4 5 4 3 4 3 3 2 2 3 2 3 3 1 2 2 2 2 4 13 2 5 2 1 1 1 1 1 1 1 1 2 1 1 1 4 6 6 11 32 26 4 1 4 9 4 4 3 3 4 7 7 10 8 4 7 10 5 3 6 6 13 6 96 29 16 10 9 5 4 1 3 7 9 7 54 30 1 3 4 4 2 3 8 8 10 5 7 5 3 11 10 8 5 3 3 3 3 3 3 3 4 2 4 2 3 2 2 2 3 4 3 2 3 4 3 2 2 4 2 3 3 1 2 1 1 2 3 14 72 8 2 1 0 3 28 5 3 3 5 4 1 1 1 0 1 1 2 1 1 1 1 0 1 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 1 1 0 0 1 1 1 1 2 3 1 1 1 1 0 2 2 2 2 2 5 5 10 4 6 9 9 7 4 14 16 17 100 23 7 6 6 5 2 5 24 41 9 4 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 1 0 1 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0; 1HNMR: 71 71 m 2H | 70 69 ddd 2H J 7 22 88 | 67 67 d 2H J 87 | 60 60 s 2H | 35 34 dt 2H J 60 112 | 34 33 dt 2H J 60 112 | 28 27 m 2H | 23 22 m 2H | 21 21 s 5H | 21 20 m 7H | 19 17 m 7H | 17 15 m 4H | 15 14 m 4H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CCOC(=O)C1CC(O)CN1C(=O)c1ccc(OC)c(OC)c1

ir: 20 20 22 17 25 21 65 34 17 30 26 10 2 12 9 5 4 6 4 7 9 6 10 5 3 4 4 4 4 4 7 1 2 3 5 10 34 34 15 24 9 8 6 3 2 5 4 2 4 6 6 5 5 8 16 20 4 6 4 2 5 7 10 7 13 13 11 5 8 15 13 7 11 18 6 6 4 4 3 2 3 3 2 3 4 4 5 6 15 100 87 26 12 15 7 4 5 5 2 11 3 4 2 5 13 6 4 8 13 14 16 6 18 30 15 9 6 12 7 11 12 11 20 20 23 17 7 5 10 10 6 14 51 6 3 2 2 2 2 3 3 4 5 13 85 73 33 12 13 5 17 5 3 6 3 3 2 0 1 2 2 1 3 6 2 0 1 2 2 0 1 3 1 0 1 2 1 0 1 2 1 0 1 2 1 1 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 2 0 1 2 2 0 1 2 1 0 1 3 2 1 1 2 2 0 1 2 1 0 1 2 1 0 1 2 1 0 2 2 1 1 2 2 2 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 4 4 1 2 4 4 4 3 5 3 6 4 8 8 30 31 48 63 26 26 6 6 9 15 27 77 46 8 4 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 1 1 1 2 1 1 2 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2; 1HNMR: 75 75 dd 1H J 20 88 | 73 73 d 1H J 20 | 70 70 d 1H J 87 | 45 45 t 1H J 71 | 43 42 qt 1H J 34 51 | 42 41 m 2H | 40 39 dd 1H J 34 118 | 39 38 d 6H J 92 | 37 36 dd 1H J 34 118 | 35 35 d 1H J 48 | 25 24 ddd 1H J 51 71 126 | 22 22 ddd 1H J 50 71 127 | 13 12 t 3H J 64

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

CCCN1c2c(cnc3ccc(OCC(=O)N4CCSCC4)cc23)NC1(N)COC

ir: 2 3 2 4 5 4 0 4 9 17 7 10 9 16 16 6 7 6 3 5 4 5 8 9 5 12 6 5 5 12 7 4 2 3 3 2 6 3 3 3 2 6 4 3 6 6 3 4 2 2 3 4 2 3 12 35 33 41 6 0 15 5 4 2 2 10 5 7 13 15 16 9 5 10 8 2 7 7 12 2 4 2 1 2 2 3 2 2 3 2 1 3 15 8 23 16 11 14 11 3 3 4 8 12 8 10 17 15 17 12 8 7 2 4 3 4 2 3 15 11 10 13 25 44 25 16 4 9 15 12 0 4 7 14 8 7 23 40 10 6 4 4 4 3 2 7 12 62 19 9 16 55 7 4 2 4 9 1 1 2 3 1 1 2 1 0 1 6 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 1 1 2 1 1 1 2 4 6 2 1 3 1 2 3 6 5 15 6 9 7 14 10 5 6 7 7 2 1 2 2 2 2 1 1 4 6 23 100 17 4 6 6 36 56 12 22 6 1 3 2 1 1 2 2 0 0 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1; 1HNMR: 84 84 s 1H | 79 78 d 1H J 83 | 76 76 d 1H J 27 | 71 70 dd 1H J 28 83 | 66 65 s 1H | 47 47 s 2H | 39 38 d 1H J 119 | 37 36 m 7H | 36 35 dt 1H J 66 133 | 32 32 s 3H | 29 28 m 4H | 17 15 m 2H | 10 9 t 3H J 72 | 3 3 s 2H

You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.