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3-TRIFLUOROMETHYL-5,6-(3,4-METHYLENEDIOXYBENZO)-1,4-OXATHIANE
SpectraBase Compound ID 9pOHOVLHXoh
InChI InChI=1S/C10H7F3O3S/c11-10(12,13)9-3-14-7-1-5-6(16-4-15-5)2-8(7)17-9/h1-2,9H,3-4H2
InChIKey DTFIPMRAGYSBSV-UHFFFAOYSA-N
Mol Weight 264.22 g/mol
Molecular Formula C10H7F3O3S
Exact Mass 264.0068 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B0KGO5Ar1Cw
Name 3-TRIFLUOROMETHYL-5,6-(3,4-METHYLENEDIOXYBENZO)-1,4-OXATHIANE
Comments NAME DEFINED (S.T.). SCALE INVERTED;WP-200SY (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H7F3O3S
InChI InChI=1S/C10H7F3O3S/c11-10(12,13)9-3-14-7-1-5-6(16-4-15-5)2-8(7)17-9/h1-2,9H,3-4H2
InChIKey DTFIPMRAGYSBSV-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