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4'-Chloro-3-phenylpropiophenone

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

4'-Chloro-3-phenylpropiophenone
SpectraBase Compound ID xnff1Nfkm6
InChI InChI=1S/C15H13ClO/c16-14-9-7-13(8-10-14)15(17)11-6-12-4-2-1-3-5-12/h1-5,7-10H,6,11H2
InChIKey GQNOPFDKLUGQEC-UHFFFAOYSA-N
Mol Weight 244.72 g/mol
Molecular Formula C15H13ClO
Exact Mass 244.065493 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 12aXvGRE18I
Name 4'-Chloro-3-phenylpropiophenone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 244.065492738 u
Formula C15H13ClO
InChI InChI=1S/C15H13ClO/c16-14-9-7-13(8-10-14)15(17)11-6-12-4-2-1-3-5-12/h1-5,7-10H,6,11H2
InChIKey GQNOPFDKLUGQEC-UHFFFAOYSA-N
Molecular Weight 244.721 g/mol
SMILES C(CCC=1C=CC=CC1)(=O)C=1C=CC(=CC1)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.923352