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(2E)-3-(4-Chlorophenyl)-1-(4-methoxyphenyl)-2-methylprop-2-en-1-one

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

(2E)-3-(4-Chlorophenyl)-1-(4-methoxyphenyl)-2-methylprop-2-en-1-one
SpectraBase Compound ID 3Bf5F4APV5J
InChI InChI=1S/C17H15ClO2/c1-12(11-13-3-7-15(18)8-4-13)17(19)14-5-9-16(20-2)10-6-14/h3-11H,1-2H3/b12-11+
InChIKey KWWLIQNJMKSPHV-VAWYXSNFSA-N
Mol Weight 286.76 g/mol
Molecular Formula C17H15ClO2
Exact Mass 286.076057 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EiEbhHYrzjp
Name (2E)-3-(4-Chlorophenyl)-1-(4-methoxyphenyl)-2-methylprop-2-en-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 286.076057421 u
Formula C17H15ClO2
InChI InChI=1S/C17H15ClO2/c1-12(11-13-3-7-15(18)8-4-13)17(19)14-5-9-16(20-2)10-6-14/h3-11H,1-2H3/b12-11+
InChIKey KWWLIQNJMKSPHV-VAWYXSNFSA-N
SMILES C=1C=C(C(\C(C)=C\C2=CC=C(C=C2)Cl)=O)C=CC1OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.950057