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3-Chloro-2-(4-methoxyphenyl)-1-phenyl-2-propen-1-one

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

3-Chloro-2-(4-methoxyphenyl)-1-phenyl-2-propen-1-one
SpectraBase Compound ID 7usKeVelWuD
InChI InChI=1S/C16H13ClO2/c1-19-14-9-7-12(8-10-14)15(11-17)16(18)13-5-3-2-4-6-13/h2-11H,1H3/b15-11+
InChIKey BFIUJWPAPNNHOF-RVDMUPIBSA-N
Mol Weight 272.73 g/mol
Molecular Formula C16H13ClO2
Exact Mass 272.060407 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2yrrEJTrhId
Name 3-Chloro-2-(4-methoxyphenyl)-1-phenyl-2-propen-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 272.060407357 u
Formula C16H13ClO2
InChI InChI=1S/C16H13ClO2/c1-19-14-9-7-12(8-10-14)15(11-17)16(18)13-5-3-2-4-6-13/h2-11H,1H3/b15-11+
InChIKey BFIUJWPAPNNHOF-RVDMUPIBSA-N
SMILES C(\C(C1=CC=C(C=C1)OC)=C\Cl)(=O)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.937587