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4-(Trifluoroacetyl)toluene
SpectraBase Compound ID 5fllstnioXE
InChI InChI=1S/C9H7F3O/c1-6-2-4-7(5-3-6)8(13)9(10,11)12/h2-5H,1H3
InChIKey DYILUJUELMWXAL-UHFFFAOYSA-N
Mol Weight 188.15 g/mol
Molecular Formula C9H7F3O
Exact Mass 188.044899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KatOBwpFfFl
Name 2,2,2-trifluoro-1-(4-methylphenyl)ethanone
Alternate Name(s) 2,2,2-trifluoro-1-(p-tolyl)ethanone 2,2,2-Trifluoro-4'-methylacetophenone 2,2,2-Trifluoro-1-(4-methylphenyl)-ethanone 2,2,2-tris(fluoranyl)-1-(4-methylphenyl)ethanone 4-(Trifluoroacetyl)toluene
CAS Registry Number 394-59-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7F3O
InChI InChI=1S/C9H7F3O/c1-6-2-4-7(5-3-6)8(13)9(10,11)12/h2-5H,1H3
InChIKey DYILUJUELMWXAL-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo301477s
Molecular Weight 188.149 g/mol
SMILES c1c(ccc(C(C(F)(F)F)=O)c1)C
SPLASH splash10-014l-7900000000-f84fdc32ea6d07b5a375
Source of Spectrum J-77-8137-3a
Wiley ID 1745270