Bio-Rad Laboratories, Inc. SpectraBase; SpectraBase Compound ID=3KpqxKPYbC8 SpectraBase Spectrum ID=FRGfMQRIHxS
http://spectrabase.com/spectrum/FRGfMQRIHxS (accessed Mar 30, 2020).

Benzoic acid
SpectraBase Compound ID 3KpqxKPYbC8
InChI InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)
InChIKey WPYMKLBDIGXBTP-UHFFFAOYSA-N
Mol Weight 122.12 g/mol
Molecular Formula C7H6O2
Exact Mass 122.03678 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID FRGfMQRIHxS
SpectraBase Batch ID 4TNksjvwlbu
Name BENZOIC-ACID
Compound Number 1
Copyright Copyright © 2016 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H6O2
InChI InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)
InChIKey WPYMKLBDIGXBTP-UHFFFAOYSA-N
Literature Reference Author O.EXNER,P.FIEDLER,M.BUDESINSKY,J.KULHANEK
Literature Reference Citation J.ORG.CHEM.,64,3513(1999)
Literature Reference DOI 10.1021/jo982282f
Molecular Weight 122.123 g/mol
Sample ID 59201
Solvent CDCl3