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2-METHYL-2-TRIFLUOROMETHYL-4,5-BENZO-1,3-OXATHIOLENE
SpectraBase Compound ID VJ4ByiCxdu
InChI InChI=1S/C9H7F3OS/c1-8(9(10,11)12)13-6-4-2-3-5-7(6)14-8/h2-5H,1H3
InChIKey ZECDZBSWCDSRBU-UHFFFAOYSA-N
Mol Weight 220.21 g/mol
Molecular Formula C9H7F3OS
Exact Mass 220.016971 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IpP3QWCvUP3
Name 2-METHYL-2-TRIFLUOROMETHYL-4,5-BENZO-1,3-OXATHIOLENE
Comments SCALE INVERTED;WP-200SY (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H7F3OS
InChI InChI=1S/C9H7F3OS/c1-8(9(10,11)12)13-6-4-2-3-5-7(6)14-8/h2-5H,1H3
InChIKey ZECDZBSWCDSRBU-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