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2-TRIFLUOROMETHYL-3-MERCAPTOPERFLUORO-2-PENTENE
SpectraBase Compound ID 5D0gMXJKFRt
InChI InChI=1S/C6HF11S/c7-3(8,6(15,16)17)2(18)1(4(9,10)11)5(12,13)14/h18H
InChIKey NGHCXLWPFGYEAQ-UHFFFAOYSA-N
Mol Weight 314.12 g/mol
Molecular Formula C6HF11S
Exact Mass 313.962331 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FRCxiv0aTFh
Name 2-TRIFLUOROMETHYL-3-MERCAPTOPERFLUORO-2-PENTENE
Comments CIS AND TRANS CF3 ARE ASSIGNED EXACTLY. SCALE INVERTED;H-60 (HITACHI)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6HF11S
InChI InChI=1S/C6HF11S/c7-3(8,6(15,16)17)2(18)1(4(9,10)11)5(12,13)14/h18H
InChIKey NGHCXLWPFGYEAQ-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference R.A.BEKKER, V.YA.POPKOVA, I.L.KNUNYANTS (1981) Izv.Akad.Nauk SSSR(Russ. Lang.):N5, 1176-1176.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported