SpectraBase Spectrum ID |
JKaRehNJkMl |
Name |
Benzeneacetic acid, .alpha.-(2-methyl-4-oxo-1-phenyl-2-pentenylidene)-, methyl ester |
CAS Registry Number |
69425-21-4 |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H20O3 |
InChI |
InChI=1S/C21H20O3/c1-15(14-16(2)22)19(17-10-6-4-7-11-17)20(21(23)24-3)18-12-8-5-9-13-18/h4-14H,1-3H3/b15-14+,20-19+ |
InChIKey |
PMWKCSIBZUMFAF-GQAAWUEQSA-N |
Molecular Weight |
320.388 g/mol |
SMILES |
C(\C=C\(\C(=C/(C(=O)OC)c1ccccc1)c1ccccc1)C)(=O)C |
SPLASH |
splash10-03di-0090000000-fb32877bdc3ad68a594f |
Source of Spectrum |
H-61-3024-0 |
Synonyms |
Methyl (2E,4E)-4-methyl-6-oxo-2,3-diphenyl-2,4-heptadienoate
Methyl ester of 4-methyl-6-oxo-2,3-diphenylhepta-2,4-dienoic acid |
Wiley ID |
1320504 |