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Phenylacetic acid

View entire compound with spectra: 51 NMR, 15 FTIR, 2 Raman, and 26 MS (GC)

Phenylacetic acid
SpectraBase Compound ID AzeJRBFs4DA
InChI InChI=1S/C8H8O2/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,9,10)
InChIKey WLJVXDMOQOGPHL-UHFFFAOYSA-N
Mol Weight 136.15 g/mol
Molecular Formula C8H8O2
Exact Mass 136.052429 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID sOb3Wn2lhK
Name Phenylacetic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number P16621
CAS Registry Number 103-82-2
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8O2
InChI InChI=1S/C8H8O2/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,9,10)
InChIKey WLJVXDMOQOGPHL-UHFFFAOYSA-N
Observed nucleus 13C
Purity 99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms alpha-Tolylic acid Benzeneacetic acid PAA
Wiley ID SIAL_13CNMR_012558