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2,4-BIS(TRIFLUOROMETHYL)-3-ETHYLTHIO-1,1,1,5,5,5-HEXAFLUOROPENT-2-ENE
SpectraBase Compound ID BPDHD6CF5iA
InChI InChI=1S/C9H6F12S/c1-2-22-3(4(6(10,11)12)7(13,14)15)5(8(16,17)18)9(19,20)21/h4H,2H2,1H3
InChIKey LTLSKUSTRVGVOH-UHFFFAOYSA-N
Mol Weight 374.19 g/mol
Molecular Formula C9H6F12S
Exact Mass 373.999859 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6aQfiLFc2Zh
Name 2,4-BIS(TRIFLUOROMETHYL)-3-ETHYLTHIO-1,1,1,5,5,5-HEXAFLUOROPENT-2-ENE
Comments SCALE INVERTED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H6F12S
InChI InChI=1S/C9H6F12S/c1-2-22-3(4(6(10,11)12)7(13,14)15)5(8(16,17)18)9(19,20)21/h4H,2H2,1H3
InChIKey LTLSKUSTRVGVOH-UHFFFAOYSA-N
Instrument Name PE R-12A
Literature Reference N.S.MIRZABEKYANTS, M.D.BARGAMOVA, YU.A.CHEBURKOV, I.L.KNUNYANTS (1974)Izv.Akad.Nauk SSSR(Russ. Lang.): N11, 2545-2547.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported