| SpectraBase Spectrum ID |
ERsUYe05Q2c |
| Name |
(S)-Ethyl 2-(2-cyclohexyl-1H-pyrrol-1-yl)-4-(methylthio)butanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H27NO2S |
| InChI |
InChI=1S/C17H27NO2S/c1-3-20-17(19)16(11-13-21-2)18-12-7-10-15(18)14-8-5-4-6-9-14/h7,10,12,14,16H,3-6,8-9,11,13H2,1-2H3/t16-/m0/s1 |
| InChIKey |
BQIOWHVJJXFPCD-INIZCTEOSA-N |
| Molecular Weight |
309.468 g/mol |
| SMILES |
c1([n](ccc1)[C@](C(=O)OCC)(CCSC)[H])C1CCCCC1 |
| SPLASH |
splash10-069r-0920000000-cf4b1a5fdfd376d729e3 |
| Source of Spectrum |
KC-61-3023-3 |
| Synonyms |
Ethyl (2S)-2-(2-cyclohexyl-1H-pyrrol-1-yl)-4-(methylsulfanyl)butanoate |
| Wiley ID |
1628301 |
