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1,1,1,6,6,6-HEXAFLUORO-3,5-DITRIFLUOROMETHYLHEXANE
SpectraBase Compound ID CyDB4ztw9Ji
InChI InChI=1S/C8H6F12/c9-5(10,11)2-1-3(6(12,13)14)4(7(15,16)17)8(18,19)20/h3-4H,1-2H2
InChIKey YBYLHFGWMIRNRN-UHFFFAOYSA-N
Mol Weight 330.12 g/mol
Molecular Formula C8H6F12
Exact Mass 330.027788 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DcXSrgLWwrA
Name 1,1,1,6,6,6-HEXAFLUORO-3,5-DITRIFLUOROMETHYLHEXANE
Comments 3RD PEAK IS MASKED, SCALE INVERTED. J=7.2 MAY BE REASSIGNED;R-20A (PERKIN-ELMER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H6F12
InChI InChI=1S/C8H6F12/c9-5(10,11)2-1-3(6(12,13)14)4(7(15,16)17)8(18,19)20/h3-4H,1-2H2
InChIKey YBYLHFGWMIRNRN-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference V.A.GRINBERG, V.R.POLISHCHUK, E.I.MYSOV, L.S.GERMAN, L.S.KANEVSKY,YU.B.VASIL'EV (1979) Izv.Akad.Nauk SSSR(Russ. Lang.): N5, 1056-1060.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported