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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 ERDnBahTMDI
Name 1,1,1-TRIFLUOROACETONE
Compound Number 1
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 H.DAHN,P.A.CARRUPT
Literature Reference Citation MAGN.RES.CHEM.,35,577(1997)
Literature Reference DOI 10.1002/(sici)1097-458x(199709)35:9<577::aid-omr129>3.3.co;2-5
Molecular Weight 112.051 g/mol
Solvent Unknown
Source File Reference UWCP4183