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2-propenoic acid, 3-fluoro-3-[(2-oxopropyl)thio]-2-(trifluoromethyl)-,methyl ester, (2E)-
SpectraBase Compound ID A7eIPbBu4dG
InChI InChI=1S/C8H8F4O3S/c1-4(13)3-16-6(9)5(7(14)15-2)8(10,11)12/h3H2,1-2H3/b6-5+
InChIKey IYEXWIVQMAABAA-AATRIKPKSA-N
Mol Weight 260.2 g/mol
Molecular Formula C8H8F4O3S
Exact Mass 260.013028 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3b578E3U0n9
Name 1,3,3,3-TETRAFLUORO-2-CARBMETHOXYPROPENYL-(2'-OXO)-PROPYLSULPHIDE
Comments (E) CONFIGURATION IS DEDUCED FROM J(F-F). SCALE INVERTED;R-32 (PERKIN-ELMER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H8F4O3S
InChI InChI=1S/C8H8F4O3S/c1-4(13)3-16-6(9)5(7(14)15-2)8(10,11)12/h3H2,1-2H3/b6-5+
InChIKey IYEXWIVQMAABAA-AATRIKPKSA-N
Instrument Name SEE COMMENT
Literature Reference R.A.BEKKER, L.A.ROZOV, V.YA.POPKOVA (1983) Izv.Akad.Nauk SSSR(Russ. Lang.): N11,2575-2581.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C6H6 benzene