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8-Ethyl-3,7-dibenzyl-8-phenyl-1,3,7,8-tetrahydro-2H-purin-2-one
SpectraBase Compound ID LIjreizNa7L
InChI InChI=1S/C27H26N4O/c1-2-27(23-16-10-5-11-17-23)29-25-24(31(27)20-22-14-8-4-9-15-22)18-28-26(32)30(25)19-21-12-6-3-7-13-21/h3-18H,2,19-20H2,1H3,(H,28,32)
InChIKey YFAKEGNIIBXEQY-UHFFFAOYSA-N
Mol Weight 422.53 g/mol
Molecular Formula C27H26N4O
Exact Mass 422.210661 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID wNu6iGiQph
Name 8-Ethyl-3,7-dibenzyl-8-phenyl-1,3,7,8-tetrahydro-2H-purin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H26N4O
InChI InChI=1S/C27H26N4O/c1-2-27(23-16-10-5-11-17-23)29-25-24(31(27)20-22-14-8-4-9-15-22)18-28-26(32)30(25)19-21-12-6-3-7-13-21/h3-18H,2,19-20H2,1H3,(H,28,32)
InChIKey YFAKEGNIIBXEQY-UHFFFAOYSA-N
Molecular Weight 422.532 g/mol
SMILES N1C=C2C(N(C1=O)Cc1ccccc1)=NC(N2Cc1ccccc1)(c1ccccc1)CC
SPLASH splash10-0006-8009000000-e4f7987176ff0bf7b983
Source of Spectrum F-52-12987-21
Synonyms 3,7-Dibenzyl-8-ethyl-8-phenyl-1,3,7,8-tetrahydro-2H-purin-2-one
Wiley ID 799287