| SpectraBase Spectrum ID |
Ir0QLNy3BRP |
| Name |
(3R,3aS,7aR)-dimethyl 4-oxo-3-(phenylthiomethyl)hexahydro-1H-indene-1,1(2H,3H)-dicarboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H24O5S |
| InChI |
InChI=1S/C20H24O5S/c1-24-18(22)20(19(23)25-2)11-13(12-26-14-7-4-3-5-8-14)17-15(20)9-6-10-16(17)21/h3-5,7-8,13,15,17H,6,9-12H2,1-2H3/t13-,15+,17+/m0/s1 |
| InChIKey |
SLEHLKVOOBKBDS-YSVLISHTSA-N |
| Literature Reference DOI |
10.1002/adsc.200505211 |
| Molecular Weight |
376.467 g/mol |
| SMILES |
C1(C[C@]([C@]2(C(CCC[C@@]12[H])=O)[H])(CSc1ccccc1)[H])(C(=O)OC)C(=O)OC |
| SPLASH |
splash10-014i-3692000000-5bab58f8ddcef99d7a2d |
| Source of Spectrum |
ASC-347-1587/SM17-11b |
| Synonyms |
(3R,3aS,7aR)-dimethyl 4-oxo-3-((phenylthio)methyl)octahydro-1H-indene-1,1-dicarboxylate |
| Wiley ID |
1767727 |
