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1-PHENYL-3,3,4,5,6,6-HEXAFLUOROCYCLOHEXA-1,4-DIENE
SpectraBase Compound ID G4GXs89C9ec
InChI InChI=1S/C12H6F6/c13-9-10(14)12(17,18)8(6-11(9,15)16)7-4-2-1-3-5-7/h1-6H
InChIKey QIHUHYYUDZHFNH-UHFFFAOYSA-N
Mol Weight 264.17 g/mol
Molecular Formula C12H6F6
Exact Mass 264.037369 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KEBAq0c16AB
Name 1-PHENYL-3,3,4,5,6,6-HEXAFLUOROCYCLOHEXA-1,4-DIENE
Comments SCALE INVERTED, -25.8, -26.7 CENTERS OF AB SYSTEMS;WP-200SY (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H6F6
InChI InChI=1S/C12H6F6/c13-9-10(14)12(17,18)8(6-11(9,15)16)7-4-2-1-3-5-7/h1-6H
InChIKey QIHUHYYUDZHFNH-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference N.B.KAZ'MINA, A.P.KURBAKOVA, L.A.LEITES, B.A.KVASOV, E.I.MYSOV (1986)Zhurn.Org.Khim.(Russ. Lang.): v.22, N8, 1668-1674.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6