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9-BENZYL-6-[2-(PARA-TOLYL)-PHENYL]-8-(PARA-TOLYL)-9H-PURINE
SpectraBase Compound ID 3m8n4T84smZ
InChI InChI=1S/C32H26N4/c1-22-12-16-25(17-13-22)27-10-6-7-11-28(27)29-30-32(34-21-33-29)36(20-24-8-4-3-5-9-24)31(35-30)26-18-14-23(2)15-19-26/h3-19,21H,20H2,1-2H3
InChIKey BNYPPRLXMGDVQM-UHFFFAOYSA-N
Mol Weight 466.6 g/mol
Molecular Formula C32H26N4
Exact Mass 466.215747 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7KZYqN6mpzv
Name 9-BENZYL-6-[2-(PARA-TOLYL)-PHENYL]-8-(PARA-TOLYL)-9H-PURINE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H26N4
InChI InChI=1S/C32H26N4/c1-22-12-16-25(17-13-22)27-10-6-7-11-28(27)29-30-32(34-21-33-29)36(20-24-8-4-3-5-9-24)31(35-30)26-18-14-23(2)15-19-26/h3-19,21H,20H2,1-2H3
InChIKey BNYPPRLXMGDVQM-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 466.585 g/mol
Sample ID 53346
Solvent CDCl3