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Pyridoxolium cation

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Pyridoxolium cation
SpectraBase Compound ID 29YEgXJ1YOZ
InChI InChI=1S/C8H11NO3/c1-5-8(12)7(4-11)6(3-10)2-9-5/h2,10-12H,3-4H2,1H3/p+1
InChIKey LXNHXLLTXMVWPM-UHFFFAOYSA-O
Mol Weight 170.19 g/mol
Molecular Formula C8H12NO3
Exact Mass 170.081718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HIZPxiUWcbJ
Name Pyridoxolium cation
Comments hydrochloride
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H12NO3
InChI InChI=1S/C8H11NO3/c1-5-8(12)7(4-11)6(3-10)2-9-5/h2,10-12H,3-4H2,1H3/p+1
InChIKey LXNHXLLTXMVWPM-UHFFFAOYSA-O
Instrument Name Bruker WM-300
Literature Reference J.T. Nelson, P.H. Nelson, Magn. Res. Chem. 25, 309 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6