SpectraBase Spectrum ID |
82iy0t7eeQx |
Name |
(2E)-2-(4-chlorobenzoyl)penta-2,4-dienethioic acid S-methyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H11ClO2S |
InChI |
InChI=1S/C13H11ClO2S/c1-3-4-11(13(16)17-2)12(15)9-5-7-10(14)8-6-9/h3-8H,1H2,2H3/b11-4+ |
InChIKey |
NLRQGWFCVBGLCU-NYYWCZLTSA-N |
Molecular Weight |
266.742 g/mol |
SMILES |
C(\C(C(=O)SC)=C/C=C)(c1ccc(cc1)Cl)=O |
SPLASH |
splash10-00kf-0980000000-dbeb2772962925be8b25 |
Source of Spectrum |
KC-0-1752-5 |
Synonyms |
(2E)-2-[(4-chlorophenyl)-oxomethyl]penta-2,4-dienethioic acid S-methyl ester
S-methyl (2E)-2-(4-chlorobenzoyl)penta-2,4-dienethioate
S-methyl (2E)-2-(4-chlorophenyl)carbonylpenta-2,4-dienethioate |
Wiley ID |
781414 |