| SpectraBase Spectrum ID |
5lWYWibu9RY |
| Name |
Benzenebutanoic acid, 2,5-dimethyl-.gamma.-oxo- |
| CAS Registry Number |
5394-59-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H14O3 |
| InChI |
InChI=1S/C12H14O3/c1-8-3-4-9(2)10(7-8)11(13)5-6-12(14)15/h3-4,7H,5-6H2,1-2H3,(H,14,15) |
| InChIKey |
XWTZKGVORJIFAF-UHFFFAOYSA-N |
| Molecular Weight |
206.241 g/mol |
| SMILES |
OC(CCC(=O)c1c(ccc(c1)C)C)=O |
| SPLASH |
splash10-0041-2900000000-5c39088e53b70c0583d8 |
| Source of Spectrum |
JX-2015-6-8697 |
| Synonyms |
4-(2,5-Dimethylphenyl)-4-oxobutanoic acid
4-(2,5-Xylyl)-4-oxobutanoic acid
.beta.-(2,5-Dimethylbenzoyl)propionic acid
4-(2,5-dimethylphenyl)-4-keto-butyric acid
4-(2,5-dimethylphenyl)-4-oxidanylidene-butanoic acid
Propionic acid, 3-(2,5-dimethylbenzoyl)-
4-(2,5-dimethylphenyl)-4-oxo-butanoic acid |
| Wiley ID |
1730028 |
