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5,5-BIS(TRIFLUOROMETHYL)-1,4-OXATHIANO[1,2-A]BENZO[5,4-A]-1,4-OXATHIANE

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5,5-BIS(TRIFLUOROMETHYL)-1,4-OXATHIANO[1,2-A]BENZO[5,4-A]-1,4-OXATHIANE
SpectraBase Compound ID 3IFGfseNkTP
InChI InChI=1S/C12H8F6O2S2/c13-11(14,15)9-3-19-5-1-6-8(2-7(5)21-9)22-10(4-20-6)12(16,17)18/h1-2,9-10H,3-4H2
InChIKey NWVOQDLBMUOPMK-UHFFFAOYSA-N
Mol Weight 362.3 g/mol
Molecular Formula C12H8F6O2S2
Exact Mass 361.986991 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HZPsnNjq9cm
Name 5,5-BIS(TRIFLUOROMETHYL)-1,4-OXATHIANO[1,2-A]BENZO[5,4-A]-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 C12H8F6O2S2
InChI InChI=1S/C12H8F6O2S2/c13-11(14,15)9-3-19-5-1-6-8(2-7(5)21-9)22-10(4-20-6)12(16,17)18/h1-2,9-10H,3-4H2
InChIKey NWVOQDLBMUOPMK-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 C2D3N acetonitrile-d