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2-METHYL-2,4-BIS(TRIFLUOROMETHYL)-1,1,1,5,5,5-HEXAFLUOROPENTANON-3
SpectraBase Compound ID GXcBJKFzX9F
InChI InChI=1S/C8H4F12O/c1-4(7(15,16)17,8(18,19)20)3(21)2(5(9,10)11)6(12,13)14/h2H,1H3
InChIKey JDMUFYDQAVHDHY-UHFFFAOYSA-N
Mol Weight 344.1 g/mol
Molecular Formula C8H4F12O
Exact Mass 344.007053 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fb73MRXcA1o
Name 2-METHYL-2,4-BIS(TRIFLUOROMETHYL)-1,1,1,5,5,5-HEXAFLUOROPENTANON-3
Comments SCALE INVERTED;H-60 (HITACHI)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H4F12O
InChI InChI=1S/C8H4F12O/c1-4(7(15,16)17,8(18,19)20)3(21)2(5(9,10)11)6(12,13)14/h2H,1H3
InChIKey JDMUFYDQAVHDHY-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference I.L.KNUNYANTS, M.V.URUSHADZE, V.A.LIVSHITS, E.G.ABDUGANIEV, E.M.ROKHLIN,YU.A.CHEBURKOV (1972) Izv.Akad.Nauk SSSR(Russ. Lang.): N1, 54-60.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4 carbon tetrachl