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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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BmgR3HtSeUU
Name 2,2,2-TRIFLUORO-1-(4-METHYLPHENYL)-1-ETHANONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. 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 Author K.STROMGAARD,D.R.SAITO,H.SHINDOU,S.ISHII,T.SHIMIZU,K.NAKANIS HI
Literature Reference Citation J.MED.CHEM.,45,4038(2002)
Literature Reference DOI 10.1021/jm020147w
Molecular Weight 188.149 g/mol
Sample ID 65079
Solvent CDCl3