SpectraBase Spectrum ID |
EPA40XbzRJq |
Name |
4-Pentenoic acid, 2-[(ethylthio)carbonyl]-2-methyl-5-phenyl-, ethyl ester |
Alternate Name(s) |
Ethyl (4Z)-2-[(ethylsulfanyl)carbonyl]-2-methyl-5-phenyl-4-pentenoate |
CAS Registry Number |
114739-22-9 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H22O3S |
InChI |
InChI=1S/C17H22O3S/c1-4-20-15(18)17(3,16(19)21-5-2)13-9-12-14-10-7-6-8-11-14/h6-12H,4-5,13H2,1-3H3/b12-9- |
InChIKey |
PUKIKXOTEBEDAX-XFXZXTDPSA-N |
Molecular Weight |
306.420 g/mol |
SMILES |
C(C(=O)SCC)(C(=O)OCC)(C\C=C/c1ccccc1)C |
SPLASH |
splash10-014i-0930000000-e9241ad64b47ff9e7ab2 |
Source of Spectrum |
C-110-4651-8 |
Wiley ID |
1308038 |