![p-[3-(2-cyanoethyl)-3-cyclohexyl-2-thioureido]benzoic acid, ethyl ester](/api/spectrum/9b02NUZalrX/structure.png?h=300&w=458 "p-[3-(2-cyanoethyl)-3-cyclohexyl-2-thioureido]benzoic acid, ethyl ester")
| SpectraBase Compound ID | 9BbKNxRL66N |
|---|---|
| InChI | InChI=1S/C19H25N3O2S/c1-2-24-18(23)15-9-11-16(12-10-15)21-19(25)22(14-6-13-20)17-7-4-3-5-8-17/h9-12,17H,2-8,14H2,1H3,(H,21,25) |
| InChIKey | ZTPASRSYNFWNBH-UHFFFAOYSA-N |
| Mol Weight | 359.49 g/mol |
| Molecular Formula | C19H25N3O2S |
| Exact Mass | 359.166748 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9b02NUZalrX |
|---|---|
| Name | p-[3-(2-cyanoethyl)-3-cyclohexyl-2-thioureido]benzoic acid, ethyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H25N3O2S |
| InChI | InChI=1S/C19H25N3O2S/c1-2-24-18(23)15-9-11-16(12-10-15)21-19(25)22(14-6-13-20)17-7-4-3-5-8-17/h9-12,17H,2-8,14H2,1H3,(H,21,25) |
| InChIKey | ZTPASRSYNFWNBH-UHFFFAOYSA-N |
| Instrument Name | Varian A-60D |
| Sadtler NMR Number | 17762M |
| Solvent | Polysol |