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3-(4-ETHENYLPHENYL)-7-METHYL-PYRIMIDO-[1,2-A]-PURIN-10(3H)-ONE
SpectraBase Compound ID IaCn4VuhZEG
InChI InChI=1S/C17H13N5O/c1-3-12-4-6-13(7-5-12)22-10-19-14-15(22)20-17-18-8-11(2)9-21(17)16(14)23/h3-10H,1H2,2H3
InChIKey PVDIGSVKJWWTJO-UHFFFAOYSA-N
Mol Weight 303.33 g/mol
Molecular Formula C17H13N5O
Exact Mass 303.11201 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HNcCiA4829r
Name 3-(4-ETHENYLPHENYL)-7-METHYL-PYRIMIDO-[1,2-A]-PURIN-10(3H)-ONE
Compound Number 5E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H13N5O
InChI InChI=1S/C17H13N5O/c1-3-12-4-6-13(7-5-12)22-10-19-14-15(22)20-17-18-8-11(2)9-21(17)16(14)23/h3-10H,1H2,2H3
InChIKey PVDIGSVKJWWTJO-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 303.323 g/mol
Solvent CDCl3
Source File Reference UWIR20895