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2-AMINO-4,6-PTERIDINEDIOL

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2-AMINO-4,6-PTERIDINEDIOL
SpectraBase Compound ID 2mEbfvrOwO6
InChI InChI=1S/2C6H5N5O2.2Na/c2*7-6-10-4-3(5(13)11-6)9-2(12)1-8-4;;/h2*1H,(H,9,12)(H3,7,8,10,11,13);;/q;;2*+1/p-2
InChIKey IWBGPFQECGGDQE-UHFFFAOYSA-L
Mol Weight 402.24153856 g/mol
Molecular Formula C12H8N10Na2O4
Exact Mass 402.052537 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8fDW3Z8qSZk
Name 2-AMINO-4,6-PTERIDINEDIOL
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H5N5O2
InChI InChI=1S/2C6H5N5O2.2Na/c2*7-6-10-4-3(5(13)11-6)9-2(12)1-8-4;;/h2*1H,(H,9,12)(H3,7,8,10,11,13);;/q;;2*+1/p-2
InChIKey IWBGPFQECGGDQE-UHFFFAOYSA-L
Melting Point 410C
Molecular Weight 179.14
Solvent Deuterium oxide/NaOD; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms XANTHOPTERIN PTERIDINEDIONE, 4,6/3H,5H/-, 1,2- DIHYDRO-2-IMINO-, 4,6-PTERIDINEDIOL, 2-AMINO-,