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3-AMINO-3-TRIFLUOROMETHYL-5-METHYL-5-CHLOROMETHYLTETRAHYDROFURAN-2-ONE(ISOMER MIXTURE)
SpectraBase Compound ID mv7fWzc8P5
InChI InChI=1S/C7H9ClF3NO2/c1-5(3-8)2-6(12,4(13)14-5)7(9,10)11/h2-3,12H2,1H3
InChIKey QUWQDADOZNIIMA-UHFFFAOYSA-N
Mol Weight 231.6 g/mol
Molecular Formula C7H9ClF3NO2
Exact Mass 231.027391 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IAv3xg0lvRY
Name 3-AMINO-3-TRIFLUOROMETHYL-5-METHYL-5-CHLOROMETHYLTETRAHYDROFURAN-2-ONE(ISOMER MIXTURE)
Comments I(-1.55):I(-2.00)=3:2. SCALE INVERTED;WP-200SY (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H9ClF3NO2
InChI InChI=1S/C7H9ClF3NO2/c1-5(3-8)2-6(12,4(13)14-5)7(9,10)11/h2-3,12H2,1H3
InChIKey QUWQDADOZNIIMA-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference S.N.OSIPOV, A.F.KOLOMIETS, A.V.FOKIN (1991) Izv.Akad.Nauk SSSR(Russ. Lang.): N5,1130-1133.
NMR Standard -CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported