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3-(4-Chlorophenyl)-2-(p-tolyl)-4H-chromen-4-one

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

3-(4-Chlorophenyl)-2-(p-tolyl)-4H-chromen-4-one
SpectraBase Compound ID CZqFMozrt9l
InChI InChI=1S/C22H15ClO2/c1-14-6-8-16(9-7-14)22-20(15-10-12-17(23)13-11-15)21(24)18-4-2-3-5-19(18)25-22/h2-13H,1H3
InChIKey CSMSPUVYROYSEG-UHFFFAOYSA-N
Mol Weight 346.81 g/mol
Molecular Formula C22H15ClO2
Exact Mass 346.076057 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5UDBn59UGF2
Name 3-(4-Chlorophenyl)-2-(p-tolyl)-4H-chromen-4-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 346.076057421 u
Formula C22H15ClO2
InChI InChI=1S/C22H15ClO2/c1-14-6-8-16(9-7-14)22-20(15-10-12-17(23)13-11-15)21(24)18-4-2-3-5-19(18)25-22/h2-13H,1H3
InChIKey CSMSPUVYROYSEG-UHFFFAOYSA-N
Molecular Weight 346.813 g/mol
SMILES C1(=C(C(C=2C=CC=CC2O1)=O)C=1C=CC(=CC1)Cl)C=1C=CC(=CC1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.862616