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Isoxanthopterine anion

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Isoxanthopterine anion
SpectraBase Compound ID HeoYAkuaMDl
InChI InChI=1S/C6H5N5O2/c7-6-10-4-3(5(13)11-6)8-1-2(12)9-4/h1H,(H4,7,9,10,11,12,13)/p-1
InChIKey GLKCOBIIZKYKFN-UHFFFAOYSA-M
Mol Weight 178.13 g/mol
Molecular Formula C6H4N5O2
Exact Mass 178.036499 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6XNIko1feWR
Name Isoxanthopterinate anion
Comments 3 N NAOH
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H4N5O2
InChI InChI=1S/C6H5N5O2/c7-6-10-4-3(5(13)11-6)8-1-2(12)9-4/h1H,(H4,7,9,10,11,12,13)/p-1
InChIKey GLKCOBIIZKYKFN-UHFFFAOYSA-M
Instrument Name Bruker HX-90
Literature Reference U. Ewers, H. Guenther, Chem. Ber. 106, 3951 (1973).
NMR Standard Dioxane
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent H2O