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2-(1-TRIFLUOROMETHYL-2-CHLOROETHYLTHIO)-4-TERT-BUTYLPHENOL
SpectraBase Compound ID GEUm877Deba
InChI InChI=1S/C13H16ClF3OS/c1-12(2,3)8-4-5-9(18)10(6-8)19-11(7-14)13(15,16)17/h4-6,11,18H,7H2,1-3H3
InChIKey VJCYNSIBPUDUHZ-UHFFFAOYSA-N
Mol Weight 312.78 g/mol
Molecular Formula C13H16ClF3OS
Exact Mass 312.056248 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LGVLxDW23Mx
Name 2-(1-TRIFLUOROMETHYL-2-CHLOROETHYLTHIO)-4-TERT-BUTYLPHENOL
Comments SCALE INVERTED;WP-200SY (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H16ClF3OS
InChI InChI=1S/C13H16ClF3OS/c1-12(2,3)8-4-5-9(18)10(6-8)19-11(7-14)13(15,16)17/h4-6,11,18H,7H2,1-3H3
InChIKey VJCYNSIBPUDUHZ-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference A.YU.SIZOV, A.F.KOLOMIETS, A.V.FOKIN (1990) Izv.Akad.Nauk SSSR(Russ. Lang.): N4,832-837.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6