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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)

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SpectraBase Spectrum ID 5peSmdToX1f
Name 4-Phenylbutyric acid
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
Ionization Type EI-B
Molecular Weight 164.204 g/mol
SMILES OC(=O)CCCc1ccccc1
SPLASH splash10-0udl-7900000000-d0dc3e324c0344c975f4
Source of Spectrum SRH-2022-10389-0
Wiley ID 1832006