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2-Phenylbutyric acid

View entire compound with spectra: 6 NMR, 8 FTIR, 1 Raman, and 9 MS (GC)

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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 57EXTgeBXAW
Name 2-PHENYLBUTYRIC ACID
Source of Sample MCB Manufacturing Chemists, Norwood, Ohio
Boiling Point 270-272C
Copyright Copyright © 1980, 1981-2025 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
Melting Point 38-40C
Molecular Weight 164.21
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian HA-100/Digilab FT-NMR-3
Synonyms BUTYRIC ACID, 2-PHENYL-,