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3-Acylium-protonated benzoic acid, dication

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3-Acylium-protonated benzoic acid, dication
SpectraBase Compound ID JzK9bWfvBMi
InChI InChI=1S/C8H6O3/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4,10-11H/q+2
InChIKey JJUFXOCNEVRMIA-UHFFFAOYSA-N
Mol Weight 150.13 g/mol
Molecular Formula C8H6O3
Exact Mass 150.031694 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9qDzO6sI6ZV
Name 3-Acylium-protonated benzoic acid, dication
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H10O3
InChI InChI=1S/C8H6O3/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4,10-11H/q+2
InChIKey JJUFXOCNEVRMIA-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference D. Bruck, M. Rabinovitz, J. Am. Chem. Soc. 99, 240 (1977).
NMR Standard Acetone-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent SBF5/SO2