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2-Phenylbutyric acid
SpectraBase Compound ID Du0r3i22lo
InChI InChI=1S/C10H12O2/c1-2-9(10(11)12)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H,11,12)
InChIKey OFJWFSNDPCAWDK-UHFFFAOYSA-N
Mol Weight 164.2 g/mol
Molecular Formula C10H12O2
Exact Mass 164.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H27gPNEN1J8
Name Benzeneacetic acid, .alpha.-ethyl-
Alternate Name(s) Butyric acid, 2-phenyl- .alpha.-Ethylphenylacetic acid .alpha.-phenyl butyric acid .alpha.-Phenyl-n-butyric acid .alpha.-Toluic acid, .alpha.-ethyl- 2-Phenylbutanoic acid 2-Phenylbutyric acid A-phenylbutyric acid AI3-11228 BRN 0509876 EINECS 201-982-5 NSC 1860
CAS Registry Number 90-27-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O2
InChI InChI=1S/C10H12O2/c1-2-9(10(11)12)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H,11,12)
InChIKey OFJWFSNDPCAWDK-UHFFFAOYSA-N
Molecular Weight 164.204 g/mol
SMILES OC(C(CC)c1ccccc1)=O
SPLASH splash10-0006-9300000000-59552d85a5677ba6c842
Source of Spectrum JZ-1992-1401-0
Wiley ID 1160188