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1-(4-Chlorophenyl)-3-hydroxy-3-phenylbutan-2-one

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

1-(4-Chlorophenyl)-3-hydroxy-3-phenylbutan-2-one
SpectraBase Compound ID rWrCWQtuEf
InChI InChI=1S/C16H15ClO2/c1-16(19,13-5-3-2-4-6-13)15(18)11-12-7-9-14(17)10-8-12/h2-10,19H,11H2,1H3
InChIKey LSEIVSIWKKKVCZ-UHFFFAOYSA-N
Mol Weight 274.75 g/mol
Molecular Formula C16H15ClO2
Exact Mass 274.076057 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID H9qIQe1Votu
Name 1-(4-Chlorophenyl)-3-hydroxy-3-phenylbutan-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 274.076057421 u
Formula C16H15ClO2
InChI InChI=1S/C16H15ClO2/c1-16(19,13-5-3-2-4-6-13)15(18)11-12-7-9-14(17)10-8-12/h2-10,19H,11H2,1H3
InChIKey LSEIVSIWKKKVCZ-UHFFFAOYSA-N
Molecular Weight 274.747 g/mol
SMILES CC(C(CC=1C=CC(Cl)=CC1)=O)(C1=CC=CC=C1)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.839069