| SpectraBase Spectrum ID |
KlofShMwKRD |
| Name |
1-Ethyl,3-S-Ethyl 6-methyl-2-(prop-1-enyl)-4-oxocyclohex-5-ene-1,3-dicarboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H22O4S |
| InChI |
InChI=1S/C16H22O4S/c1-5-8-11-13(15(18)20-6-2)10(4)9-12(17)14(11)16(19)21-7-3/h5,8-9,11,13-14H,6-7H2,1-4H3 |
| InChIKey |
AQYQEESBCJMOCW-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1002/jccs.200300064 |
| Molecular Weight |
310.408 g/mol |
| SMILES |
C1(C)=CC(=O)C(C(=O)SCC)C(C=CC)C1C(OCC)=O |
| SPLASH |
splash10-0002-9151000000-ace2c7e5a55c0e1ca872 |
| Source of Spectrum |
QA-50-423-4f |
| Synonyms |
Ethyl 5-((ethylthio)carbonyl)-2-methyl-4-oxo-6-(prop-1-en-1-yl)cyclohex-2-ene-1-carboxylate |
| Wiley ID |
1795771 |
