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2-Methyl-4-oxo-4-phenylbutyric acid
SpectraBase Compound ID 7ZyyeYLCsUl
InChI InChI=1S/C11H12O3/c1-8(11(13)14)7-10(12)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,13,14)
InChIKey ICXWGAZLLKCSAT-UHFFFAOYSA-N
Mol Weight 192.21 g/mol
Molecular Formula C11H12O3
Exact Mass 192.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DeUAGfoRhTW
Name Benzenebutanoic acid, .alpha.-methyl-.gamma.-oxo-
CAS Registry Number 1771-65-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O3
InChI InChI=1S/C11H12O3/c1-8(11(13)14)7-10(12)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,13,14)
InChIKey ICXWGAZLLKCSAT-UHFFFAOYSA-N
Molecular Weight 192.214 g/mol
SMILES OC(C(C)CC(c1ccccc1)=O)=O
SPLASH splash10-0a4i-5900000000-21b826be055316b8797a
Source of Spectrum OS-5-419-0
Synonyms 2-Methyl-4-oxo-4-phenylbutanoic acid .beta.-Benzoyl-.alpha.-methylpropionic acid 2-Methyl-3-benzoylpropionic acid 2-Methyl-4-oxidanylidene-4-phenyl-butanoic acid 4-keto-2-methyl-4-phenyl-butyric acid Propionic acid, 3-benzoyl-2-methyl-
Wiley ID 1188309