| SpectraBase Spectrum ID |
dO6pFH0K7a |
| Name |
(2R,3S)-dimethyl 2-isopropyl-3-(phenylthiomethyl)-4-propylcyclopentane-1,1-dicarboxylate |
| Alternate Name(s) |
(2R,3S)-dimethyl 2-isopropyl-3-((phenylthio)methyl)-4-propylcyclopentane-1,1-dicarboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H32O4S |
| InChI |
InChI=1S/C22H32O4S/c1-6-10-16-13-22(20(23)25-4,21(24)26-5)19(15(2)3)18(16)14-27-17-11-8-7-9-12-17/h7-9,11-12,15-16,18-19H,6,10,13-14H2,1-5H3/t16?,18-,19+/m0/s1 |
| InChIKey |
WUAAJBBKZOJRQJ-NGFYBIIMSA-N |
| Literature Reference DOI |
10.1002/adsc.200505211 |
| Molecular Weight |
392.554 g/mol |
| SMILES |
C1(CC([C@](CSc2ccccc2)([C@]1(C(C)C)[H])[H])CCC)(C(=O)OC)C(=O)OC |
| SPLASH |
splash10-00di-4920000000-56e0fd49c578ce3435fb |
| Source of Spectrum |
ASC-347-1587/SM12-3m_dia_1 |
| Wiley ID |
1767773 |
