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p-Chlorophenyl phenylethynyl ketone

View entire compound with spectra: 1 NMR, 1 FTIR, and 3 MS (GC)

p-Chlorophenyl phenylethynyl ketone
SpectraBase Compound ID 7JSjBcjNMbg
InChI InChI=1S/C15H9ClO/c16-14-9-7-13(8-10-14)15(17)11-6-12-4-2-1-3-5-12/h1-5,7-10H
InChIKey ORAGQXBNCMMOIW-UHFFFAOYSA-N
Mol Weight 240.69 g/mol
Molecular Formula C15H9ClO
Exact Mass 240.034193 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Jf1E2MUZf07
Name p-Chlorophenyl phenylethynyl ketone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 240.034192609 u
Formula C15H9ClO
InChI InChI=1S/C15H9ClO/c16-14-9-7-13(8-10-14)15(17)11-6-12-4-2-1-3-5-12/h1-5,7-10H
InChIKey ORAGQXBNCMMOIW-UHFFFAOYSA-N
Molecular Weight 240.689 g/mol
SMILES C1(Cl)=CC=C(C=C1)C(=O)C#CC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.921091