| SpectraBase Spectrum ID |
6iCKDUdcAdt |
| Name |
Benzenepropanoic acid, .beta.-oxo-.alpha.-(2-oxopropylidene)-, ethyl ester |
| Alternate Name(s) |
Ethyl (2Z)-2-benzoyl-4-oxo-2-pentenoate
Ethylester of 2-benzoyl-4-oxo-2-pentenecarboxylic acid |
| CAS Registry Number |
80569-27-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H14O4 |
| InChI |
InChI=1S/C14H14O4/c1-3-18-14(17)12(9-10(2)15)13(16)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3/b12-9- |
| InChIKey |
GRPJHGGYFGQBLX-XFXZXTDPSA-N |
| Molecular Weight |
246.262 g/mol |
| SMILES |
C(\C(C(=O)OCC)=C\C(=O)C)(=O)c1ccccc1 |
| SPLASH |
splash10-0uea-0090000000-2d4255a7eb38422a9020 |
| Source of Spectrum |
K-114-3874-0 |
| Wiley ID |
1248945 |
