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2-TRIFLUOROMETHYL-3-ETHYLTHIOPERFLUORO-2-PENTENE
SpectraBase Compound ID KEYmPsxkQdh
InChI InChI=1S/C8H5F11S/c1-2-20-4(5(9,10)8(17,18)19)3(6(11,12)13)7(14,15)16/h2H2,1H3
InChIKey OINRDCXWAHXUAJ-UHFFFAOYSA-N
Mol Weight 342.17 g/mol
Molecular Formula C8H5F11S
Exact Mass 341.993631 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AqQckGwxlpW
Name 2-TRIFLUOROMETHYL-3-ETHYLTHIOPERFLUORO-2-PENTENE
Comments CIS AND TRANS CF3 ARE ASSIGNED EXACTLY. SCALE INVERTED;R-32 (PERKIN-ELMER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H5F11S
InChI InChI=1S/C8H5F11S/c1-2-20-4(5(9,10)8(17,18)19)3(6(11,12)13)7(14,15)16/h2H2,1H3
InChIKey OINRDCXWAHXUAJ-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference R.A.BEKKER, V.YA.POPKOVA, I.L.KNUNYANTS (1982) Izv.Akad.Nauk SSSR(Russ. Lang.):N10, 2347-2354.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported