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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1yMGzTqxQu
Name Benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. 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
Instrument Name Shimadzu GLC 17-A-QP5050A
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202001027
Molecular Weight 122.123 g/mol
SMILES OC(c1ccccc1)=O
SPLASH splash10-0ab9-2900000000-84590efb502a7197cb27
Source of Spectrum U1-2020-SM14-10
Wiley ID 1860973