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Bis-(4-trifluoromethyl-phenyl)-methanone

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

Bis-(4-trifluoromethyl-phenyl)-methanone
SpectraBase Compound ID FiFKlEmc19Y
InChI InChI=1S/C15H8F6O/c16-14(17,18)11-5-1-9(2-6-11)13(22)10-3-7-12(8-4-10)15(19,20)21/h1-8H
InChIKey YHKDMJOYMRUGBQ-UHFFFAOYSA-N
Mol Weight 318.22 g/mol
Molecular Formula C15H8F6O
Exact Mass 318.047934 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9sT0SQI9yt0
Name bis-(4-Trifluoromethyl-phenyl)-methanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 318.047933855 u
Formula C15H8F6O
InChI InChI=1S/C15H8F6O/c16-14(17,18)11-5-1-9(2-6-11)13(22)10-3-7-12(8-4-10)15(19,20)21/h1-8H
InChIKey YHKDMJOYMRUGBQ-UHFFFAOYSA-N
Molecular Weight 318.218 g/mol
SMILES C(F)(C1=CC=C(C(C2=CC=C(C(F)(F)F)C=C2)=O)C=C1)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.886513