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7-METHYL-3-(4-METHYLPHENYL)-PYRIMIDO-[1,2-A]-PURIN-10(3H)-ONE
SpectraBase Compound ID ACSsbrqJRSo
InChI InChI=1S/C16H13N5O/c1-10-3-5-12(6-4-10)21-9-18-13-14(21)19-16-17-7-11(2)8-20(16)15(13)22/h3-9H,1-2H3
InChIKey YPNIFYKGHMQYKO-UHFFFAOYSA-N
Mol Weight 291.31 g/mol
Molecular Formula C16H13N5O
Exact Mass 291.11201 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LVmLOC0rwzI
Name 7-METHYL-3-(4-METHYLPHENYL)-PYRIMIDO-[1,2-A]-PURIN-10(3H)-ONE
Compound Number 5D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H13N5O
InChI InChI=1S/C16H13N5O/c1-10-3-5-12(6-4-10)21-9-18-13-14(21)19-16-17-7-11(2)8-20(16)15(13)22/h3-9H,1-2H3
InChIKey YPNIFYKGHMQYKO-UHFFFAOYSA-N
Literature Reference Author R.KEDER,H.DVORAKOVA,D.DVORAK
Literature Reference Citation EUR.J.ORG.CHEM.,2009,1522(2009)
Literature Reference DOI 10.1002/ejoc.200801002
Molecular Weight 291.312 g/mol
Solvent CDCl3
Source File Reference UWIR20892