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2-(4-Methoxyphenyl)-6-[(E)-2-phenylethen-1-yl]-9-phenylmethyl-9H-purine
SpectraBase Compound ID 4xx7un9wrDi
InChI InChI=1S/C27H22N4O/c1-32-23-15-13-22(14-16-23)26-29-24(17-12-20-8-4-2-5-9-20)25-27(30-26)31(19-28-25)18-21-10-6-3-7-11-21/h2-17,19H,18H2,1H3/b17-12+
InChIKey ZVMREZKHLZKXNT-SFQUDFHCSA-N
Mol Weight 418.5 g/mol
Molecular Formula C27H22N4O
Exact Mass 418.179361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Pj5BUoqnLI
Name 2-(4-Methoxyphenyl)-6-[(E)-2-phenylethen-1-yl]-9-phenylmethyl-9H-purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H22N4O
InChI InChI=1S/C27H22N4O/c1-32-23-15-13-22(14-16-23)26-29-24(17-12-20-8-4-2-5-9-20)25-27(30-26)31(19-28-25)18-21-10-6-3-7-11-21/h2-17,19H,18H2,1H3/b17-12+
InChIKey ZVMREZKHLZKXNT-SFQUDFHCSA-N
Literature Reference DOI 10.1002/ardp.200400951
Molecular Weight 418.500 g/mol
SMILES c1nc2c(nc(nc2[n]1Cc1ccccc1)-c1ccc(cc1)OC)\C=C\c1ccccc1
SPLASH splash10-014i-1003900000-fd5557f91ceb42351296
Source of Spectrum APC-338-165-7p
Synonyms (E)-9-benzyl-2-(4-methoxyphenyl)-6-styryl-9H-purine 9-Benzyl-2-(4-methoxyphenyl)-6-[(E)-2-phenylethenyl]purine 2-(4-Methoxyphenyl)-6-[(E)-2-phenylethenyl]-9-(phenylmethyl)purine
Wiley ID 1768703