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5H-2,3-Benzodiazepine, 1-(4-methylphenyl)-4-phenyl-

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

5H-2,3-Benzodiazepine, 1-(4-methylphenyl)-4-phenyl-
SpectraBase Compound ID JQPJzQQJYlk
InChI InChI=1S/C22H18N2/c1-16-11-13-18(14-12-16)22-20-10-6-5-9-19(20)15-21(23-24-22)17-7-3-2-4-8-17/h2-14H,15H2,1H3
InChIKey YMTHPABJDCQRML-UHFFFAOYSA-N
Mol Weight 310.4 g/mol
Molecular Formula C22H18N2
Exact Mass 310.146999 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID VpKv871nx7
Name 5H-2,3-Benzodiazepine, 1-(4-methylphenyl)-4-phenyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 310.146998588 u
Formula C22H18N2
InChI InChI=1S/C22H18N2/c1-16-11-13-18(14-12-16)22-20-10-6-5-9-19(20)15-21(23-24-22)17-7-3-2-4-8-17/h2-14H,15H2,1H3
InChIKey YMTHPABJDCQRML-UHFFFAOYSA-N
Molecular Weight 310.400 g/mol
SMILES C1(=NN=C(C=2C(C1)=CC=CC2)C=1C=CC(=CC1)C)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.801682