![p-[2-thio-3-(3,3,5-trimethylcyclohexyl)ureido]benzoic acid, ethyl ester](/api/spectrum/36rZy3jY1x6/structure.png?h=300&w=458 "p-[2-thio-3-(3,3,5-trimethylcyclohexyl)ureido]benzoic acid, ethyl ester")
| SpectraBase Compound ID | CSkZvYKf9Tb |
|---|---|
| InChI | InChI=1S/C19H28N2O2S/c1-5-23-17(22)14-6-8-15(9-7-14)20-18(24)21-16-10-13(2)11-19(3,4)12-16/h6-9,13,16H,5,10-12H2,1-4H3,(H2,20,21,24) |
| InChIKey | CCNNVFBTJJBSOC-UHFFFAOYSA-N |
| Mol Weight | 348.51 g/mol |
| Molecular Formula | C19H28N2O2S |
| Exact Mass | 348.187149 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 36rZy3jY1x6 |
|---|---|
| Name | p-[2-thio-3-(3,3,5-trimethylcyclohexyl)ureido]benzoic acid, ethyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H28N2O2S |
| InChI | InChI=1S/C19H28N2O2S/c1-5-23-17(22)14-6-8-15(9-7-14)20-18(24)21-16-10-13(2)11-19(3,4)12-16/h6-9,13,16H,5,10-12H2,1-4H3,(H2,20,21,24) |
| InChIKey | CCNNVFBTJJBSOC-UHFFFAOYSA-N |
| Instrument Name | Varian A-60D |
| Sadtler NMR Number | 17903M |
| Solvent | Polysol |