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[3,3,4,4,5,5,5-heptafluoro-2,2-bis(trifluoromethyl)pentyl]benzene
SpectraBase Compound ID 9PiaP71FQmC
InChI InChI=1S/C13H7F13/c14-9(15,10(16,17)13(24,25)26)8(11(18,19)20,12(21,22)23)6-7-4-2-1-3-5-7/h1-5H,6H2
InChIKey UERGJYOTMNFNRT-UHFFFAOYSA-N
Mol Weight 410.18 g/mol
Molecular Formula C13H7F13
Exact Mass 410.034016 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5iIW2lbtSLM
Name 1-PHENYL-2,2-BIS(TRIFLUOROMETHYL)-3,3,4,4,5,5,5-HEPTAFLUOROPENTANE
Comments SCALE INVERTED;H-60 (HITACHI)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H7F13
InChI InChI=1S/C13H7F13/c14-9(15,10(16,17)13(24,25)26)8(11(18,19)20,12(21,22)23)6-7-4-2-1-3-5-7/h1-5H,6H2
InChIKey UERGJYOTMNFNRT-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference K.N.MAKAROV, L.L.GERVITS, I.L.KNUNYANTS (1977) J.Fluor.Chem.: v.10, N2, 157-158.
NMR Standard CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported