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Phenylacetic acid

View entire compound with spectra: 51 NMR, 15 FTIR, 2 Raman, and 29 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) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Dop5LCqSmf
Name Phenylacetic acid
CAS Registry Number 103-82-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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
Instrument Name Bruker WH-90
Literature Reference J.L. Marshall, L.G. Faehl, A.M.Ihrig, J. Am. Chem. Soc. 98, 3406 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Acetone-D6