| SpectraBase Spectrum ID |
CE9xNFbC93L |
| Name |
Benzenepropanoic acid, .beta.-oxo-.alpha.-propylidene-, methyl ester, (E)- |
| CAS Registry Number |
109542-26-9 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H14O3 |
| InChI |
InChI=1S/C13H14O3/c1-3-7-11(13(15)16-2)12(14)10-8-5-4-6-9-10/h4-9H,3H2,1-2H3/b11-7+ |
| InChIKey |
PLWBUDWZKCZBKQ-YRNVUSSQSA-N |
| Molecular Weight |
218.252 g/mol |
| SMILES |
C(\C(C(=O)OC)=C/CC)(=O)c1ccccc1 |
| SPLASH |
splash10-0a70-3910000000-bfc18eb01d559aa27fa6 |
| Source of Spectrum |
KC-1986-1957-48 |
| Synonyms |
Methyl (2E)-2-benzoyl-2-pentenoate
Methyl 2-benzoyl-pent-2-enoate |
| Wiley ID |
1217740 |
