| SpectraBase Spectrum ID |
9DqA2gKiBpx |
| Name |
4-Hexenoic acid, 5-methyl-2-(phenylthio)-2-(trifluoromethyl)-, ethyl ester, (.+-.)- |
| CAS Registry Number |
134427-77-3 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H19F3O2S |
| InChI |
InChI=1S/C16H19F3O2S/c1-4-21-14(20)15(16(17,18)19,11-10-12(2)3)22-13-8-6-5-7-9-13/h5-10H,4,11H2,1-3H3 |
| InChIKey |
CZHYQSMKSNWQJF-UHFFFAOYSA-N |
| Molecular Weight |
332.381 g/mol |
| SMILES |
C(C(F)(F)F)(C(=O)OCC)(Sc1ccccc1)CC=C(C)C |
| SPLASH |
splash10-0300-7790000000-ffa14f11666538f6a6ba |
| Source of Spectrum |
F-47-1641-6 |
| Synonyms |
Ethyl 5-methyl-2-(phenylsulfanyl)-2-(trifluoromethyl)-4-hexenoate
Ethyl 5-methyl-2-(phenylthio)-2-(trifluoromethyl)-4-hexenoate |
| Wiley ID |
1329178 |
