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DIMETHYL 1,2,2,3,3-PENTAFLUOROCYCLOHEXANE-CIS-1,4-DICARBOXYLATE
SpectraBase Compound ID 28tFHgjloAk
InChI InChI=1S/C10H11F5O4/c1-18-6(16)5-3-4-8(11,7(17)19-2)10(14,15)9(5,12)13/h5H,3-4H2,1-2H3/t5-,8-/m1/s1
InChIKey PPCHKVJAEXEZND-SVGQVSJJSA-N
Mol Weight 290.19 g/mol
Molecular Formula C10H11F5O4
Exact Mass 290.05775 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gzzv2W5CiEK
Name DIMETHYL 1,2,2,3,3-PENTAFLUOROCYCLOHEXANE-CIS-1,4-DICARBOXYLATE
Comments SCALE INVERTED; STEREODESCRIPTORS ARE RELATIVE; CF2 ARE ASSIGNED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H11F5O4
InChI InChI=1S/C10H11F5O4/c1-18-6(16)5-3-4-8(11,7(17)19-2)10(14,15)9(5,12)13/h5H,3-4H2,1-2H3/t5-,8-/m1/s1
InChIKey PPCHKVJAEXEZND-SVGQVSJJSA-N
Instrument Name Varian HA-100
Literature Reference J.BATTERSBY, R.STEPHENS, J.C.TATLOW (1977) J.Fluor.Chem.: v.9, N2, 127-135.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4 carbon tetrachl