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6-Chloro-3-phenethyl-2-phenyl-1,2-dihydroquinazoline-4-thione

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

6-Chloro-3-phenethyl-2-phenyl-1,2-dihydroquinazoline-4-thione
SpectraBase Compound ID DQUWWeK7GDb
InChI InChI=1S/C22H19ClN2S/c23-18-11-12-20-19(15-18)22(26)25(14-13-16-7-3-1-4-8-16)21(24-20)17-9-5-2-6-10-17/h1-12,15,21,24H,13-14H2
InChIKey AEULJWUQTDFMPE-UHFFFAOYSA-N
Mol Weight 378.92 g/mol
Molecular Formula C22H19ClN2S
Exact Mass 378.095747 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID mheyEki30e
Name 6-Chloro-3-phenethyl-2-phenyl-1,2-dihydroquinazoline-4-thione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 378.095747494 u
Formula C22H19ClN2S
InChI InChI=1S/C22H19ClN2S/c23-18-11-12-20-19(15-18)22(26)25(14-13-16-7-3-1-4-8-16)21(24-20)17-9-5-2-6-10-17/h1-12,15,21,24H,13-14H2
InChIKey AEULJWUQTDFMPE-UHFFFAOYSA-N
Molecular Weight 378.921 g/mol
SMILES C1(NC=2C=CC(=CC2C(N1CCC=1C=CC=CC1)=S)Cl)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.954509