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1-[(5,8-DIMETHOXY-7-METHYL-NAPHTHALEN-2-YL)-METHYL]-1,3-DIMETHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE
SpectraBase Compound ID KX4htVI4JK5
InChI InChI=1S/C21H22N4O4/c1-12-8-16(28-4)14-7-6-13(9-15(14)18(12)29-5)10-25-20(26)17-19(22-11-23(17)2)24(3)21(25)27/h6-9,11H,10H2,1-5H3
InChIKey YMQJLEIIFXQRMW-UHFFFAOYSA-N
Mol Weight 394.43 g/mol
Molecular Formula C21H22N4O4
Exact Mass 394.164105 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ClR1aH9dy7d
Name 1-[(5,8-DIMETHOXY-7-METHYL-NAPHTHALEN-2-YL)-METHYL]-1,3-DIMETHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE
Compound Number 50
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22N4O4
InChI InChI=1S/C21H22N4O4/c1-12-8-16(28-4)14-7-6-13(9-15(14)18(12)29-5)10-25-20(26)17-19(22-11-23(17)2)24(3)21(25)27/h6-9,11H,10H2,1-5H3
InChIKey YMQJLEIIFXQRMW-UHFFFAOYSA-N
Literature Reference Author X.R.CUI,R.SAITO,T.KUBO,D.KON,Y.HIRANO,S.SAITO
Literature Reference Citation CHEM.PHARM.BULL.,59,302(2011)
Literature Reference DOI 10.1248/cpb.59.302
Molecular Weight 394.430 g/mol
Sample ID 2742
Solvent CDCl3