| SpectraBase Spectrum ID |
F4KJa3TIxme |
| Name |
4-Phenylsulfanylmethylcyclopentane-1,1,3-tricarboxylic acid 3-ethyl ester 1,1-dimethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H24O6S |
| InChI |
InChI=1S/C19H24O6S/c1-4-25-16(20)15-11-19(17(21)23-2,18(22)24-3)10-13(15)12-26-14-8-6-5-7-9-14/h5-9,13,15H,4,10-12H2,1-3H3 |
| InChIKey |
JSXSGPWNLVHBCJ-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1002/adsc.200505211 |
| Molecular Weight |
380.455 g/mol |
| SMILES |
C1(CC(C(C1)CSc1ccccc1)C(=O)OCC)(C(=O)OC)C(=O)OC |
| SPLASH |
splash10-076r-5960000000-66033388c547cabeb76f |
| Source of Spectrum |
ASC-347-1587/SM9-3a_mixture |
| Synonyms |
3-Ethyl 1,1-dimethyl 4-((phenylthio)methyl)cyclopentane-1,1,3-tricarboxylate |
| Wiley ID |
1767763 |
