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5-Benzyl-2-(4-methoxyphenyl)-6-(4-methylphenyl)-5H-pyrrolo[2,3-b]pyrazine
SpectraBase Compound ID 53D1YNmiqnw
InChI InChI=1S/C27H23N3O/c1-19-8-10-22(11-9-19)26-16-24-27(30(26)18-20-6-4-3-5-7-20)28-17-25(29-24)21-12-14-23(31-2)15-13-21/h3-17H,18H2,1-2H3
InChIKey BWRONMZMTVLYEH-UHFFFAOYSA-N
Mol Weight 405.5 g/mol
Molecular Formula C27H23N3O
Exact Mass 405.184112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gro7vJBDXBZ
Name 5-Benzyl-2-(4-methoxyphenyl)-6-(4-methylphenyl)-5H-pyrrolo[2,3-b]pyrazine
Appearance White solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H23N3O
InChI InChI=1S/C27H23N3O/c1-19-8-10-22(11-9-19)26-16-24-27(30(26)18-20-6-4-3-5-7-20)28-17-25(29-24)21-12-14-23(31-2)15-13-21/h3-17H,18H2,1-2H3
InChIKey BWRONMZMTVLYEH-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 5988A
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.p008.720
Molecular Weight 405.501 g/mol
Reported Formula C27H22F3N3O
SMILES c1([n](c2c(c1)nc(cn2)-c1ccc(cc1)OC)Cc1ccccc1)-c1ccc(cc1)C
SPLASH splash10-0a4j-3155900000-d1e57e22add0d8163839
Source of Spectrum ARK-2014-336-7c
Wiley ID 1845641