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3-OXA-6,7-DIAZA-8-TRIFLUOROMETHYL-8-(PARA-TOLYL)BICYCLO[3.3.0]OCT-6-EN-2,4-DIONE
SpectraBase Compound ID ARfD3VAgcOA
InChI InChI=1S/C13H9F3N2O3/c1-6-2-4-7(5-3-6)12(13(14,15)16)8-9(17-18-12)11(20)21-10(8)19/h2-5,8-9H,1H3
InChIKey QFODFNOEIPLOLB-UHFFFAOYSA-N
Mol Weight 298.22 g/mol
Molecular Formula C13H9F3N2O3
Exact Mass 298.056527 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4xinPpCTOy5
Name 3-OXA-6,7-DIAZA-8-TRIFLUOROMETHYL-8-(PARA-TOLYL)BICYCLO[3.3.0]OCT-6-EN-2,4-DIONE
Comments C=10%. MAY BE R-32 (PERKIN-ELMER). SCALE INVERTED;WP-200SY (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H9F3N2O3
InChI InChI=1S/C13H9F3N2O3/c1-6-2-4-7(5-3-6)12(13(14,15)16)8-9(17-18-12)11(20)21-10(8)19/h2-5,8-9H,1H3
InChIKey QFODFNOEIPLOLB-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference V.V.LINEV, A.F.KOLOMIETS, A.V.FOKIN (1991) Izv.Akad.Nauk SSSR(Russ. Lang.): N7,1589-1593.
NMR Standard -CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6