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pyridoxol, sulfate (2:1)

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pyridoxol, sulfate (2:1)
SpectraBase Compound ID 1aocME2wU4c
InChI InChI=1S/2C8H11NO3.H2O4S/c2*1-5-8(12)7(4-11)6(3-10)2-9-5;1-5(2,3)4/h2*2,10-12H,3-4H2,1H3;(H2,1,2,3,4)
InChIKey OQVZJPXVELZGCV-UHFFFAOYSA-N
Mol Weight 436.43 g/mol
Molecular Formula C16H24N2O10S
Exact Mass 436.115166 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HzpEJ25lyS8
Name PYRIDOXOL, SULFATE (2:1) (SALT)
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula 2C8H11NO3 H2SO4
InChI InChI=1S/2C8H11NO3.H2O4S/c2*1-5-8(12)7(4-11)6(3-10)2-9-5;1-5(2,3)4/h2*2,10-12H,3-4H2,1H3;(H2,1,2,3,4)
InChIKey OQVZJPXVELZGCV-UHFFFAOYSA-N
Melting Point 179-182C
Molecular Weight 436.44
Solvent Deuterium oxide; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms VITAMIN B6, SULFATE /2 TO 1/ PYRIDOXOL, SULFATE /2 TO 1/ PYRIDOXINE, SULFATE /2 TO 1/ 3,4-PYRIDINEMETHANOL, 5-HYDROXY-6- METHYL-, SULFATE /2 TO 1/