| SpectraBase Spectrum ID |
69SLs84dlcQ |
| Name |
1,4-Cyclohexadiene-1-acetic acid, 5-methoxy-.alpha.-methyl-.alpha.-(methylthio)-, methyl ester, (.+-.)- |
| CAS Registry Number |
122124-77-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H18O3S |
| InChI |
InChI=1S/C12H18O3S/c1-12(16-4,11(13)15-3)9-6-5-7-10(8-9)14-2/h6-7H,5,8H2,1-4H3 |
| InChIKey |
FQLOTASKDXTJFG-UHFFFAOYSA-N |
| Molecular Weight |
242.333 g/mol |
| SMILES |
C=1(C(C(=O)OC)(SC)C)CC(OC)=CCC1 |
| SPLASH |
splash10-0002-0910000000-24b1ecdc38064209ffdd |
| Source of Spectrum |
F-44-4382-9 |
| Synonyms |
Methyl 2-(5-methoxy-1,4-cyclohexadien-1-yl)-2-(methylsulfanyl)propanoate
Methyl 2-(5-methoxy-1,4-cyclohexadienyl)-2-methylsulfenylpropionate |
| Wiley ID |
1244803 |
