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1,5-DIMETHYLALLOPURINOL
SpectraBase Compound ID 2Jwlwp1sqrK
InChI InChI=1S/C7H8N4O/c1-10-4-8-6-5(7(10)12)3-9-11(6)2/h3-4H,1-2H3
InChIKey PVQKQWMEXZGTMR-UHFFFAOYSA-N
Mol Weight 164.17 g/mol
Molecular Formula C7H8N4O
Exact Mass 164.069811 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CAC3ray2k6F
Name 1,5-DIMETHYLALLOPURINOL
Comments 0
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Formula C7H8N4O
InChI InChI=1S/C7H8N4O/c1-10-4-8-6-5(7(10)12)3-9-11(6)2/h3-4H,1-2H3
InChIKey PVQKQWMEXZGTMR-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