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1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one
SpectraBase Compound ID AB504CExPLT
InChI InChI=1S/C6H6N4O/c1-10-5-4(2-9-10)6(11)8-3-7-5/h2-3H,1H3,(H,7,8,11)
InChIKey CDJQIJFWTUEUFF-UHFFFAOYSA-N
Mol Weight 150.14 g/mol
Molecular Formula C6H6N4O
Exact Mass 150.054161 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4qwzFncS4vq
Name 1-METHYLALLOPURINOL
Comments 10
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H6N4O
InChI InChI=1S/C6H6N4O/c1-10-5-4(2-9-10)6(11)8-3-7-5/h2-3H,1H3,(H,7,8,11)
InChIKey CDJQIJFWTUEUFF-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference T.A.BABUSHKINA, T.S.LEONOVA, A.I.CHERNYSHEV, V, G, YASHUNSKY (1979)Khim.Heteroc.Soed.(Russ. Lang.): N11, 1543-1546.
NMR Standard C6H18N3PO hexamethyl
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C6H18N3OP hexamethyl