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pyridoxal, diethyl acetal, hydrochloride, hydrate

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pyridoxal, diethyl acetal, hydrochloride, hydrate
SpectraBase Compound ID 9qfgydLfwrJ
InChI InChI=1S/C12H19NO4.ClH.H2O/c1-4-16-12(17-5-2)10-9(7-14)6-13-8(3)11(10)15;;/h6,12,14-15H,4-5,7H2,1-3H3;1H;1H2
InChIKey JTBFBGODFBNXTO-UHFFFAOYSA-N
Mol Weight 295.76 g/mol
Molecular Formula C12H22ClNO5
Exact Mass 295.118651 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7U05riGIXLE
Name pyridoxal, diethyl acetal, hydrochloride, hydrate
Source of Sample Calbiochem, Los Angeles, California
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22ClNO5
InChI InChI=1S/C12H19NO4.ClH.H2O/c1-4-16-12(17-5-2)10-9(7-14)6-13-8(3)11(10)15;;/h6,12,14-15H,4-5,7H2,1-3H3;1H;1H2
InChIKey JTBFBGODFBNXTO-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 5084M
Solvent D2O
Synonyms PYRIDOXAL, DIETHYL ACETAL, HYDRO- CHLORIDE, HYDRATE