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Pyridoxylidene L-aspartate

View entire compound with spectra: 1 NMR

Pyridoxylidene L-aspartate
SpectraBase Compound ID HtoIcPFSRKo
InChI InChI=1S/C12H14N2O6/c1-6-11(18)8(7(5-15)3-13-6)4-14-9(12(19)20)2-10(16)17/h3-4,9,15,18H,2,5H2,1H3,(H,16,17)(H,19,20)/b14-4+
InChIKey YQGAPVZGBQNZMO-LNKIKWGQSA-N
Mol Weight 282.25 g/mol
Molecular Formula C12H14N2O6
Exact Mass 282.085186 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I1cxne0cp75
Name Pyridoxylidene L-aspartate
CAS Registry Number 13934-01-5
Comments PH = 9.1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H14N2O6
InChI InChI=1S/C12H14N2O6/c1-6-11(18)8(7(5-15)3-13-6)4-14-9(12(19)20)2-10(16)17/h3-4,9,15,18H,2,5H2,1H3,(H,16,17)(H,19,20)/b14-4+
InChIKey YQGAPVZGBQNZMO-LNKIKWGQSA-N
Instrument Name Varian XL-100
Literature Reference R.C. Harruff, W.T. Jenkins, Org. Magn. Resonance 8, 548 (1976).
NMR Standard Dioxane
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent H2O