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2-METHYL-4-TRIFLUOROMETHYL-4-DIFLUORONITROMETHYL-6-PHENYL-4H-1,3,5-OXADIAZINE
SpectraBase Compound ID 5oCZLd4SPit
InChI InChI=1S/C12H8F5N3O3/c1-7-18-10(11(13,14)15,12(16,17)20(21)22)19-9(23-7)8-5-3-2-4-6-8/h2-6H,1H3
InChIKey NCLZUKVLNOQPPR-UHFFFAOYSA-N
Mol Weight 337.21 g/mol
Molecular Formula C12H8F5N3O3
Exact Mass 337.048582 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DJMOTyNHfPa
Name 2-METHYL-4-TRIFLUOROMETHYL-4-DIFLUORONITROMETHYL-6-PHENYL-4H-1,3,5-OXADIAZINE
Comments SCALE INVERTED;H-60 (HITACHI)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H8F5N3O3
InChI InChI=1S/C12H8F5N3O3/c1-7-18-10(11(13,14)15,12(16,17)20(21)22)19-9(23-7)8-5-3-2-4-6-8/h2-6H,1H3
InChIKey NCLZUKVLNOQPPR-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference Z.V.SAFRONOVA, L.A.SIMONYAN, YU.V.ZEIFMAN, N.P.GAMBARYAN (1979) Izv.Akad.NaukSSSR(Russ. Lang.): N8, 1826-1830.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4 carbon tetrachl