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2-KETO-3-TRIFLUOROMETHYL-4,4,4-TRIFLUOROBUTYL ALPHA-HYDROHEXAFLUOROISOBUTYRATE
SpectraBase Compound ID KvGuK5xdLJl
InChI InChI=1S/C9H4F12O3/c10-6(11,12)3(7(13,14)15)2(22)1-24-5(23)4(8(16,17)18)9(19,20)21/h3-4H,1H2
InChIKey FZTACORPBIOWNM-UHFFFAOYSA-N
Mol Weight 388.11 g/mol
Molecular Formula C9H4F12O3
Exact Mass 387.996882 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L4FImWWTt7C
Name 2-KETO-3-TRIFLUOROMETHYL-4,4,4-TRIFLUOROBUTYL ALPHA-HYDROHEXAFLUOROISOBUTYRATE
Comments SCALE INVERTED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H4F12O3
InChI InChI=1S/C9H4F12O3/c10-6(11,12)3(7(13,14)15)2(22)1-24-5(23)4(8(16,17)18)9(19,20)21/h3-4H,1H2
InChIKey FZTACORPBIOWNM-UHFFFAOYSA-N
Instrument Name PE R-12A
Literature Reference E.G.TERT-GABRIELYAN, E.A.AVETISYAN, N.P.GAMBARYAN (1973) Izv.Akad.NaukSSSR(Russ. Lang.): N11, 2562-2566.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2H3N acetonitrile