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1,3,6,7-Tetrahydro-1,3,7-tribenzyl-2H-purin-2-one
SpectraBase Compound ID 2LAF4VAEkzf
InChI InChI=1S/C26H24N4O/c31-26-28(16-21-10-4-1-5-11-21)19-24-25(30(26)18-23-14-8-3-9-15-23)27-20-29(24)17-22-12-6-2-7-13-22/h1-15,20H,16-19H2
InChIKey OLZKTCITDPGKNR-UHFFFAOYSA-N
Mol Weight 408.51 g/mol
Molecular Formula C26H24N4O
Exact Mass 408.195011 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4gWJFWuResK
Name 1,3,6,7-Tetrahydro-1,3,7-tribenzyl-2H-purin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H24N4O
InChI InChI=1S/C26H24N4O/c31-26-28(16-21-10-4-1-5-11-21)19-24-25(30(26)18-23-14-8-3-9-15-23)27-20-29(24)17-22-12-6-2-7-13-22/h1-15,20H,16-19H2
InChIKey OLZKTCITDPGKNR-UHFFFAOYSA-N
Molecular Weight 408.505 g/mol
SMILES c12N(C(N(Cc2[n](Cc2ccccc2)cn1)Cc1ccccc1)=O)Cc1ccccc1
SPLASH splash10-0b90-0009700000-1773336fc4af04ab5a81
Source of Spectrum F-51-3663-8
Synonyms 1,3,7-tribenzyl-1,3,6,7-tetrahydro-2H-purin-2-one
Wiley ID 791417