| SpectraBase Spectrum ID |
KZWZI1gNMF6 |
| Name |
(2E)-2-benzoylpenta-2,4-dienethioic acid S-methyl ester |
| Alternate Name(s) |
S-methyl (2E)-2-(phenylcarbonyl)penta-2,4-dienethioate
S-methyl (2E)-2-benzoylpenta-2,4-dienethioate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H12O2S |
| InChI |
InChI=1S/C13H12O2S/c1-3-7-11(13(15)16-2)12(14)10-8-5-4-6-9-10/h3-9H,1H2,2H3/b11-7+ |
| InChIKey |
KPSLCIYRKIBVQH-YRNVUSSQSA-N |
| Molecular Weight |
232.297 g/mol |
| SMILES |
C(\C(C(=O)SC)=C/C=C)(=O)c1ccccc1 |
| SPLASH |
splash10-0a4r-0900000000-62eb558305356629cf72 |
| Source of Spectrum |
KC-0-1751-5 |
| Wiley ID |
781416 |
