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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 1FjrAqHvhFL
Name PHENYLACETIC_ACID
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. 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
Literature Reference Author A.EVIDENTE,A.ANDOLFI,L.MADDAU,A.FRANCESCHINI,F.MARRAS
Literature Reference Citation J.NAT.PROD.,68,568(2005)
Literature Reference DOI 10.1021/np049621m
Molecular Weight 136.150 g/mol
Solvent CDCl3
Source File Reference UWMZ7900