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1-Benzyl-2,6-diphenyl-4-(4'-chlorophenyl)-2,3-dihydropyrazolo[3,4-b][1,4]diazepine

View entire compound with spectra: 1 MS (GC)

1-Benzyl-2,6-diphenyl-4-(4'-chlorophenyl)-2,3-dihydropyrazolo[3,4-b][1,4]diazepine
SpectraBase Compound ID B3qjTqDPd6h
InChI InChI=1S/C31H25ClN4/c32-27-16-18-28(19-17-27)34-22-26(25-12-6-2-7-13-25)20-33-31-30(34)23-35(29-14-8-3-9-15-29)36(31)21-24-10-4-1-5-11-24/h1-20,22H,21,23H2
InChIKey DFJNELAQGYWRFO-UHFFFAOYSA-N
Mol Weight 489.02 g/mol
Molecular Formula C31H25ClN4
Exact Mass 488.176775 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JSXlA8hqGcJ
Name 1-Benzyl-2,6-diphenyl-4-(4'-chlorophenyl)-2,3-dihydropyrazolo[3,4-b][1,4]diazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H25ClN4
InChI InChI=1S/C31H25ClN4/c32-27-16-18-28(19-17-27)34-22-26(25-12-6-2-7-13-25)20-33-31-30(34)23-35(29-14-8-3-9-15-29)36(31)21-24-10-4-1-5-11-24/h1-20,22H,21,23H2
InChIKey DFJNELAQGYWRFO-UHFFFAOYSA-N
Molecular Weight 489.022 g/mol
SMILES C12=C(N(Cc3ccccc3)N(C1)c1ccccc1)N=CC(=CN2c1ccc(cc1)Cl)c1ccccc1
SPLASH splash10-000i-0002900000-40cc4d1f007a5b8b3d14
Source of Spectrum Y-34-1132-3
Synonyms 1-Benzyl-4-(4-chlorophenyl)-2,6-diphenyl-1,2,3,4-tetrahydropyrazolo[3,4-b][1,4]diazepine
Wiley ID 1396971