| SpectraBase Spectrum ID |
KOk1Xakz30f |
| Name |
3-Phenylsulfanylmethyloctahydroindene-1,1-dicarboxylic acid dimethyl ester |
| Alternate Name(s) |
Dimethyl 3-((phenylthio)methyl)octahydro-1H-indene-1,1-dicarboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H26O4S |
| InChI |
InChI=1S/C20H26O4S/c1-23-18(21)20(19(22)24-2)12-14(16-10-6-7-11-17(16)20)13-25-15-8-4-3-5-9-15/h3-5,8-9,14,16-17H,6-7,10-13H2,1-2H3 |
| InChIKey |
GXYNKPFQZBMAJE-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1002/adsc.200505211 |
| Molecular Weight |
362.484 g/mol |
| SMILES |
C1(CC(C2CCCCC12)CSc1ccccc1)(C(=O)OC)C(=O)OC |
| SPLASH |
splash10-000x-4900000000-9edf031c283c53002ac6 |
| Source of Spectrum |
ASC-347-1587/SM19-13b |
| Wiley ID |
1767732 |
