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3-TRIFLUOROMETHYL-5,6-(3-ETHYLBENZO)-1,4-OXATHIANE
SpectraBase Compound ID Kc256xvmcIx
InChI InChI=1S/C11H11F3OS/c1-2-7-3-4-8-9(5-7)16-10(6-15-8)11(12,13)14/h3-5,10H,2,6H2,1H3
InChIKey OCVGLDVGNCKZMM-UHFFFAOYSA-N
Mol Weight 248.26 g/mol
Molecular Formula C11H11F3OS
Exact Mass 248.048271 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID faqd4lHTpB
Name 3-TRIFLUOROMETHYL-5,6-(3-ETHYLBENZO)-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 C11H11F3OS
InChI InChI=1S/C11H11F3OS/c1-2-7-3-4-8-9(5-7)16-10(6-15-8)11(12,13)14/h3-5,10H,2,6H2,1H3
InChIKey OCVGLDVGNCKZMM-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