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(Pentafluorophenyl)(2,4,5-trimethylphenyl)methanone

View entire compound with spectra: 1 FTIR

(Pentafluorophenyl)(2,4,5-trimethylphenyl)methanone
SpectraBase Compound ID 61M4xO6zEqy
InChI InChI=1S/C16H11F5O/c1-6-4-8(3)9(5-7(6)2)16(22)10-11(17)13(19)15(21)14(20)12(10)18/h4-5H,1-3H3
InChIKey APMQKIMBNSUSQZ-UHFFFAOYSA-N
Mol Weight 314.26 g/mol
Molecular Formula C16H11F5O
Exact Mass 314.073006 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FRE9WwuW2ze
Name (Pentafluorophenyl)(2,4,5-trimethylphenyl)methanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 314.073005788 u
Formula C16H11F5O
InChI InChI=1S/C16H11F5O/c1-6-4-8(3)9(5-7(6)2)16(22)10-11(17)13(19)15(21)14(20)12(10)18/h4-5H,1-3H3
InChIKey APMQKIMBNSUSQZ-UHFFFAOYSA-N
Molecular Weight 314.255 g/mol
SMILES C(C1=C(C(=C(C(=C1F)F)F)F)F)(=O)C1=CC(=C(C=C1C)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.876696