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1,6-Dimethyl-5-(3-chloro-phenyl)-pyrazolo(3,4-D)pyrimidin-4(5H)-one
SpectraBase Compound ID BZzO76mvTC5
InChI InChI=1S/C13H11ClN4O/c1-8-16-12-11(7-15-17(12)2)13(19)18(8)10-5-3-4-9(14)6-10/h3-7H,1-2H3
InChIKey AATOYQODLAJBAJ-UHFFFAOYSA-N
Mol Weight 274.71 g/mol
Molecular Formula C13H11ClN4O
Exact Mass 274.062139 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3j4fpl09pHu
Name 1,6-Dimethyl-5-(3-chloro-phenyl)-pyrazolo(3,4-D)pyrimidin-4(5H)-one
CAS Registry Number 88320-58-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H11ClN4O
InChI InChI=1S/C13H11ClN4O/c1-8-16-12-11(7-15-17(12)2)13(19)18(8)10-5-3-4-9(14)6-10/h3-7H,1-2H3
InChIKey AATOYQODLAJBAJ-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference P. Finlander, S.V. Nielsen, E.B. Pedersen, Chemica Scripta 22, 171 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6