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9-BENZYL-6-CYANO-2-METHYLPURINE
SpectraBase Compound ID BrIIJjIHIwg
InChI InChI=1S/C14H11N5/c1-10-17-12(7-15)13-14(18-10)19(9-16-13)8-11-5-3-2-4-6-11/h2-6,9H,8H2,1H3
InChIKey ZZAFOJMQZAOGEV-UHFFFAOYSA-N
Mol Weight 249.28 g/mol
Molecular Formula C14H11N5
Exact Mass 249.101445 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 686dqbN0xEI
Name 9-BENZYL-6-CYANO-2-METHYLPURINE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H11N5
InChI InChI=1S/C14H11N5/c1-10-17-12(7-15)13-14(18-10)19(9-16-13)8-11-5-3-2-4-6-11/h2-6,9H,8H2,1H3
InChIKey ZZAFOJMQZAOGEV-UHFFFAOYSA-N
Literature Reference Author M.J.ALVES,M.F.J.R.P.PROENCA,B.L.BOOTH
Literature Reference Citation J.HETCYCL.CHEM.,31,345(1994)
Literature Reference DOI 10.1002/jhet.5570310215
Molecular Weight 249.275 g/mol
Solvent CDCl3
Source File Reference UWCS18458