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1,1,1-trifluoro-2-propanone

View entire compound with spectra: 21 NMR, 4 FTIR, and 4 MS (GC)

1,1,1-trifluoro-2-propanone
SpectraBase Compound ID CyxEoQoWtkZ
InChI InChI=1S/C3H3F3O/c1-2(7)3(4,5)6/h1H3
InChIKey FHUDAMLDXFJHJE-UHFFFAOYSA-N
Mol Weight 112.051 g/mol
Molecular Formula C3H3F3O
Exact Mass 112.013599 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 43uNK7lvZgX
Name 1,1,1-TRIFLUOROACETONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C3H3F3O
InChI InChI=1S/C3H3F3O/c1-2(7)3(4,5)6/h1H3
InChIKey FHUDAMLDXFJHJE-UHFFFAOYSA-N
Literature Reference Author R.J.ABRAHAM,A.D.JONES,M.A.WARNE,R.RITTNER,C.F.TORMENA
Literature Reference Citation J.CHEM.SOC.PERKIN-2,533(1996)
Literature Reference DOI 10.1039/p29960000533
Molecular Weight 112.051 g/mol
Solvent CD3NO2
Source File Reference UWCS21955