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3-TRIFLUOROMETHYL-6-TERT-BUTYLBENZO-1,4-OXATHIANOXIDE
SpectraBase Compound ID CaiAu1iH6Mf
InChI InChI=1S/C13H15F3O2S/c1-12(2,3)8-4-5-9-10(6-8)19(17)11(7-18-9)13(14,15)16/h4-6,11H,7H2,1-3H3
InChIKey AZADBCPNWIJXFO-UHFFFAOYSA-N
Mol Weight 292.32 g/mol
Molecular Formula C13H15F3O2S
Exact Mass 292.074485 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B59LKWkt7uj
Name 3-TRIFLUOROMETHYL-6-TERT-BUTYLBENZO-1,4-OXATHIANOXIDE
Comments SCALE INVERTED;WP-200SY (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H15F3O2S
InChI InChI=1S/C13H15F3O2S/c1-12(2,3)8-4-5-9-10(6-8)19(17)11(7-18-9)13(14,15)16/h4-6,11H,7H2,1-3H3
InChIKey AZADBCPNWIJXFO-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