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Benzenecarboxylic 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 122.036779 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7nwIf2nuijo
Name BENZOIC_ACID
Copyright Copyright © 2016-2024 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 A.L.BAUMSTARK,P.BALAKRISHNAN,M.DOTRONG,C.J.MCCLOSKEY,M.G.OAK LEY,D.W.BOYKIN
Literature Reference Citation J.AM.CHEM.SOC.,109,1059(1987)
Literature Reference DOI 10.1021/ja00238a013
Solvent CH3CN
Source File Reference UHPK300