![p-{3-[(2-pyridyl)methyl]-2-thioureido}benzoic acid, ethyl ester](/api/spectrum/IW46Zk5OK69/structure.png?h=300&w=458 "p-{3-[(2-pyridyl)methyl]-2-thioureido}benzoic acid, ethyl ester")
| SpectraBase Compound ID | AN1vVzXaKhG |
|---|---|
| InChI | InChI=1S/C16H17N3O2S/c1-2-21-15(20)12-6-8-13(9-7-12)19-16(22)18-11-14-5-3-4-10-17-14/h3-10H,2,11H2,1H3,(H2,18,19,22) |
| InChIKey | VTBCDZUJNQTRKD-UHFFFAOYSA-N |
| Mol Weight | 315.39 g/mol |
| Molecular Formula | C16H17N3O2S |
| Exact Mass | 315.104148 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IW46Zk5OK69 |
|---|---|
| Name | p-{3-[(2-pyridyl)methyl]-2-thioureido}benzoic acid, ethyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H17N3O2S |
| InChI | InChI=1S/C16H17N3O2S/c1-2-21-15(20)12-6-8-13(9-7-12)19-16(22)18-11-14-5-3-4-10-17-14/h3-10H,2,11H2,1H3,(H2,18,19,22) |
| InChIKey | VTBCDZUJNQTRKD-UHFFFAOYSA-N |
| Instrument Name | Varian A-60D |
| Sadtler NMR Number | 17824M |
| Solvent | Polysol |