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2-(1,1,1-TRIFLUORO-3-CHLOROPROP-2-YLTHIO)-4,5-METHYLENEDIOXYPHENOL
SpectraBase Compound ID 7HLD9esaDGp
InChI InChI=1S/C10H8ClF3O3S/c11-3-9(10(12,13)14)18-8-2-7-6(1-5(8)15)16-4-17-7/h1-2,9,15H,3-4H2
InChIKey RQVLDOWBELYUMW-UHFFFAOYSA-N
Mol Weight 300.68 g/mol
Molecular Formula C10H8ClF3O3S
Exact Mass 299.983477 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CABavpVZJd8
Name 2-(1,1,1-TRIFLUORO-3-CHLOROPROP-2-YLTHIO)-4,5-METHYLENEDIOXYPHENOL
Comments NAME DEFINED (S.T.). SCALE INVERTED;WP-200SY (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H8ClF3O3S
InChI InChI=1S/C10H8ClF3O3S/c11-3-9(10(12,13)14)18-8-2-7-6(1-5(8)15)16-4-17-7/h1-2,9,15H,3-4H2
InChIKey RQVLDOWBELYUMW-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference A.YU.SIZOV, A.F.KOLOMIETS, A.V.FOKIN (1991) Izv.Akad.Nauk SSSR(Russ. Lang.): N7,1625-1630.
NMR Standard -CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6