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7-chloro-2-methyl-3-(o-tolyl)-4(3H)-quinazolinone

View entire compound with spectra: 1 NMR, 1 FTIR, 1 Raman, and 2 UV-Vis

7-chloro-2-methyl-3-(o-tolyl)-4(3H)-quinazolinone
SpectraBase Compound ID 7QRyudLBp44
InChI InChI=1S/C16H13ClN2O/c1-10-5-3-4-6-15(10)19-11(2)18-14-9-12(17)7-8-13(14)16(19)20/h3-9H,1-2H3
InChIKey IHBJTADWNIJVJR-UHFFFAOYSA-N
Mol Weight 284.75 g/mol
Molecular Formula C16H13ClN2O
Exact Mass 284.071641 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID KdbFEWh9Z27
Name 7-Chloro-2-methyl-3-(o-tolyl)-4(3H)-quinazolinone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 284.071640746 u
Formula C16H13ClN2O
InChI InChI=1S/C16H13ClN2O/c1-10-5-3-4-6-15(10)19-11(2)18-14-9-12(17)7-8-13(14)16(19)20/h3-9H,1-2H3
InChIKey IHBJTADWNIJVJR-UHFFFAOYSA-N
Molecular Weight 284.746 g/mol
SMILES C=12C=CC(=CC1N=C(N(C2=O)C=1C(=CC=CC1)C)C)Cl
Spectrum/Structure Validation Score (Raman) 0.717298