For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4-Phenylbutyric acid

View entire compound with spectra: 5 NMR, 6 FTIR, 10 MS (GC), and 2 Near IR

4-Phenylbutyric acid
SpectraBase Compound ID F9zjdR4G5vL
InChI InChI=1S/C10H12O2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,11,12)
InChIKey OBKXEAXTFZPCHS-UHFFFAOYSA-N
Mol Weight 164.2 g/mol
Molecular Formula C10H12O2
Exact Mass 164.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HAK907YSThS
Name Benzenebutanoic acid
CAS Registry Number 1821-12-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O2
InChI InChI=1S/C10H12O2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,11,12)
InChIKey OBKXEAXTFZPCHS-UHFFFAOYSA-N
Molecular Weight 164.204 g/mol
SMILES OC(=O)CCCc1ccccc1
SPLASH splash10-0udl-6900000000-cf83e62b4071fe4af991
Source of Spectrum NP-2-1399-0
Synonyms .gamma.-Phenyl-n-butyric acid Butyric acid, 4-phenyl- .gamma.-Phenylbutyric acid .omega.-Phenylbutanoic acid 1-Phenylbutyric acid 4-Phenyl-butyric acid 4-Phenylbutanoic acid 4-Phenyl-n-butyric acid Benzenebutyric acid Gamma-phenyl-n-butyric acid gamma-Phenylbutyric acid Omega-phenylbutanoic acid Phenylbutyric acid AI3-12065 EINECS 217-341-8 NSC 295
Wiley ID 1100404