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4-(2-METHOXYCARBONYL-1,1,1,3,3,3-HEXAFLUOROPROP-2-YLTHIO)-3-HYDROXYPHENOL
SpectraBase Compound ID KS2VwGpUYJU
InChI InChI=1S/C11H8F6O4S/c1-21-8(20)9(10(12,13)14,11(15,16)17)22-7-3-2-5(18)4-6(7)19/h2-4,18-19H,1H3
InChIKey LBIMZEASSZJODX-UHFFFAOYSA-N
Mol Weight 350.23 g/mol
Molecular Formula C11H8F6O4S
Exact Mass 350.004749 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HeicOD08gDg
Name 4-(2-METHOXYCARBONYL-1,1,1,3,3,3-HEXAFLUOROPROP-2-YLTHIO)-3-HYDROXYPHENOL
Comments SCALE INVERTED;WP-200SY (BRUKER)
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Formula C11H8F6O4S
InChI InChI=1S/C11H8F6O4S/c1-21-8(20)9(10(12,13)14,11(15,16)17)22-7-3-2-5(18)4-6(7)19/h2-4,18-19H,1H3
InChIKey LBIMZEASSZJODX-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference A.YU.SIZOV, A.F.KOLOMIETS, A.V.FOKIN (1991) Izv.Akad.Nauk SSSR(Russ. Lang.): N7,1619-1625.
NMR Standard -CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6