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9-BENZYL-6-PHENYL-8-(ORTHO-TOLYL)-9H-PURINE
SpectraBase Compound ID VnXINY8ywh
InChI InChI=1S/C25H20N4/c1-18-10-8-9-15-21(18)24-28-23-22(20-13-6-3-7-14-20)26-17-27-25(23)29(24)16-19-11-4-2-5-12-19/h2-15,17H,16H2,1H3
InChIKey KGKMWBURBDRMQZ-UHFFFAOYSA-N
Mol Weight 376.46 g/mol
Molecular Formula C25H20N4
Exact Mass 376.168797 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7bdZEMs0KX6
Name 9-BENZYL-6-PHENYL-8-(ORTHO-TOLYL)-9H-PURINE
Compound Number 2D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H20N4
InChI InChI=1S/C25H20N4/c1-18-10-8-9-15-21(18)24-28-23-22(20-13-6-3-7-14-20)26-17-27-25(23)29(24)16-19-11-4-2-5-12-19/h2-15,17H,16H2,1H3
InChIKey KGKMWBURBDRMQZ-UHFFFAOYSA-N
Literature Reference Author I.CERNA,R.POHL,B.KLEPETAROVA,M.HOCEK
Literature Reference Citation ORG.LETTERS,8,5389(2006)
Literature Reference DOI 10.1021/ol062324j
Molecular Weight 376.461 g/mol
Sample ID 53351
Solvent CDCl3