![1-[m-tolyl(thiocarbamoyl)]-4-piperidinecarboxylic acid, ethyl ester](/api/spectrum/FZbeeSwKUZ7/structure.png?h=300&w=458 "1-[m-tolyl(thiocarbamoyl)]-4-piperidinecarboxylic acid, ethyl ester")
| SpectraBase Compound ID | AQ3BfMFjwD1 |
|---|---|
| InChI | InChI=1S/C16H22N2O2S/c1-3-20-15(19)13-7-9-18(10-8-13)16(21)17-14-6-4-5-12(2)11-14/h4-6,11,13H,3,7-10H2,1-2H3,(H,17,21) |
| InChIKey | VYXIFHVFUDJZER-UHFFFAOYSA-N |
| Mol Weight | 306.42 g/mol |
| Molecular Formula | C16H22N2O2S |
| Exact Mass | 306.140199 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FZbeeSwKUZ7 |
|---|---|
| Name | 1-[m-tolyl(thiocarbamoyl)]-4-piperidinecarboxylic acid, ethyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H22N2O2S |
| InChI | InChI=1S/C16H22N2O2S/c1-3-20-15(19)13-7-9-18(10-8-13)16(21)17-14-6-4-5-12(2)11-14/h4-6,11,13H,3,7-10H2,1-2H3,(H,17,21) |
| InChIKey | VYXIFHVFUDJZER-UHFFFAOYSA-N |
| Instrument Name | Varian A-60 |
| Polar Surface Area Predicted | 41.57 |
| Sadtler NMR Number | 22541M |
| Solvent | CDCl3 |