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O-toluic acid

View entire compound with spectra: 46 NMR, 8 FTIR, 1 UV-Vis, and 11 MS (GC)

O-toluic acid
SpectraBase Compound ID HHInqBEEzoZ
InChI InChI=1S/C8H8O2/c1-6-4-2-3-5-7(6)8(9)10/h2-5H,1H3,(H,9,10)
InChIKey ZWLPBLYKEWSWPD-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 9urIfzZeARe
Name 2-Methyl-benzoic acid
CAS Registry Number 118-90-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H8O2
InChI InChI=1S/C8H8O2/c1-6-4-2-3-5-7(6)8(9)10/h2-5H,1H3,(H,9,10)
InChIKey ZWLPBLYKEWSWPD-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference J.L. Marshall, L.G. Faehl, R. Kattner, Org. Magn. Resonance 12, 169 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3