| SpectraBase Spectrum ID |
7n0hYb3xcV3 |
| Name |
Methyl cis-2-{N-[2-(1-p-Toluenesulfonyl)-1-pentenyl]amino}-trans-6-methylcyclohexanecarboxylate |
| Alternate Name(s) |
Methyl (1R,2S,6S)-2-methyl-6-({(1E)-2-[(4-methylphenyl)sulfonyl]-1-pentenyl}amino)cyclohexanecarboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H31NO4S |
| InChI |
InChI=1S/C21H31NO4S/c1-5-7-18(27(24,25)17-12-10-15(2)11-13-17)14-22-19-9-6-8-16(3)20(19)21(23)26-4/h10-14,16,19-20,22H,5-9H2,1-4H3/b18-14+/t16-,19-,20+/m0/s1 |
| InChIKey |
GSFANBHKHHSKHT-ZUMSINNKSA-N |
| Molecular Weight |
393.542 g/mol |
| SMILES |
N(\C=C/(S(c1ccc(cc1)C)(=O)=O)CCC)[C@@]1([C@](C(=O)OC)([C@@](C)(CCC1)[H])[H])[H] |
| SPLASH |
splash10-001v-9030000000-95f63de262ddb4ba292e |
| Source of Spectrum |
J-63-6570-15 |
| Wiley ID |
1366263 |
![Methyl cis-2-{N-[2-(1-p-Toluenesulfonyl)-1-pentenyl]amino}-trans-6-methylcyclohexanecarboxylate](/api/spectrum/7n0hYb3xcV3/structure.png?h=300&w=458 "Methyl cis-2-{N-[2-(1-p-Toluenesulfonyl)-1-pentenyl]amino}-trans-6-methylcyclohexanecarboxylate")
