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1-(4-Chlorophenyl)-3-(phenylmethyl)-4H-quinazolin-2-one

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

1-(4-Chlorophenyl)-3-(phenylmethyl)-4H-quinazolin-2-one
SpectraBase Compound ID 4X5bVWqp2fo
InChI InChI=1S/C21H17ClN2O/c22-18-10-12-19(13-11-18)24-20-9-5-4-8-17(20)15-23(21(24)25)14-16-6-2-1-3-7-16/h1-13H,14-15H2
InChIKey WOHVRENMFXDWKG-UHFFFAOYSA-N
Mol Weight 348.83 g/mol
Molecular Formula C21H17ClN2O
Exact Mass 348.102941 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ee5AMo9YtNW
Name 1-(4-Chlorophenyl)-3-(phenylmethyl)-4H-quinazolin-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 348.102940874 u
Formula C21H17ClN2O
InChI InChI=1S/C21H17ClN2O/c22-18-10-12-19(13-11-18)24-20-9-5-4-8-17(20)15-23(21(24)25)14-16-6-2-1-3-7-16/h1-13H,14-15H2
InChIKey WOHVRENMFXDWKG-UHFFFAOYSA-N
Molecular Weight 348.833 g/mol
SMILES C1(N(C=2C=CC=CC2CN1CC=1C=CC=CC1)C=1C=CC(=CC1)Cl)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.862892