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

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

3-(4-Chlorophenyl)-3-hydroxy-1-phenylbutan-2-one
SpectraBase Compound ID 6n6XxBoTScC
InChI InChI=1S/C16H15ClO2/c1-16(19,13-7-9-14(17)10-8-13)15(18)11-12-5-3-2-4-6-12/h2-10,19H,11H2,1H3
InChIKey BMVFNYKNGFAABP-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 CRi0tJEP2GJ
Name 3-(4-Chlorophenyl)-3-hydroxy-1-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(19,13-7-9-14(17)10-8-13)15(18)11-12-5-3-2-4-6-12/h2-10,19H,11H2,1H3
InChIKey BMVFNYKNGFAABP-UHFFFAOYSA-N
Molecular Weight 274.747 g/mol
SMILES CC(O)(C=1C=CC(=CC1)Cl)C(=O)CC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.850311