| SpectraBase Spectrum ID |
3G9J5HgkPNa |
| Name |
(2R,3S)-diethyl 2-pentyl-3-(phenylthiomethyl)-4-propylcyclopentane-1,1-dicarboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H40O4S |
| InChI |
InChI=1S/C26H40O4S/c1-5-9-11-17-23-22(19-31-21-15-12-10-13-16-21)20(14-6-2)18-26(23,24(27)29-7-3)25(28)30-8-4/h10,12-13,15-16,20,22-23H,5-9,11,14,17-19H2,1-4H3/t20?,22-,23+/m0/s1 |
| InChIKey |
IADFXKNLRKNVPO-XGELLPRESA-N |
| Literature Reference DOI |
10.1002/adsc.200505211 |
| Molecular Weight |
448.662 g/mol |
| SMILES |
C1([C@@]([C@](C(C1)CCC)(CSc1ccccc1)[H])(CCCCC)[H])(C(=O)OCC)C(=O)OCC |
| SPLASH |
splash10-00r6-7950000000-81cbc7cbba821e534576 |
| Source of Spectrum |
ASC-347-1587/SM13-3p_A |
| Synonyms |
(2R,3S)-diethyl 2-pentyl-3-((phenylthio)methyl)-4-propylcyclopentane-1,1-dicarboxylate |
| Wiley ID |
1767776 |
