SpectraBase Spectrum ID |
Gff9xVgQ2Jq |
Name |
Benzoic acid, 3,4-dimethyl-2-(3-methyl-1-oxobutyl)- |
CAS Registry Number |
71940-31-3 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H18O3 |
InChI |
InChI=1S/C14H18O3/c1-8(2)7-12(15)13-10(4)9(3)5-6-11(13)14(16)17/h5-6,8H,7H2,1-4H3,(H,16,17) |
InChIKey |
RDEVXWSNDVLNRA-UHFFFAOYSA-N |
Molecular Weight |
234.295 g/mol |
SMILES |
OC(c1c(c(C)c(cc1)C)C(=O)CC(C)C)=O |
SPLASH |
splash10-0fb9-0960000000-dfbd3a0b3b7eb85e4fed |
Source of Spectrum |
H-62-1529-0 |
Synonyms |
3,4-Dimethyl-2-(3-methylbutanoyl)benzoic acid
2-isovaleryl-3,4-dimethyl-benzoic acid
3,4-Dimethyl-2-(3-methyl-1-oxobutyl)benzoic acid |
Wiley ID |
1236083 |