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2-Hydroxy-2-trifluoromethyl-4H-benzo[1,4]oxazin-3-one
SpectraBase Compound ID DJHoAAqMM4D
InChI InChI=1S/C9H6F3NO3/c10-9(11,12)8(15)7(14)13-5-3-1-2-4-6(5)16-8/h1-4,15H,(H,13,14)
InChIKey QDPPYJJMUMSMIL-UHFFFAOYSA-N
Mol Weight 233.15 g/mol
Molecular Formula C9H6F3NO3
Exact Mass 233.029978 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LhuTkyS4155
Name 2-HYDROXY-2-TRIFLUOROMETHYL-2,3H-1,4-BENZOXAZINONE-3
Comments STANDARD IS DEDUCED TO BE CF3COOH. SCALE MAY BE INVERTED (S.T.);WP-200 (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H6F3NO3
InChI InChI=1S/C9H6F3NO3/c10-9(11,12)8(15)7(14)13-5-3-1-2-4-6(5)16-8/h1-4,15H,(H,13,14)
InChIKey QDPPYJJMUMSMIL-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference V.I.D'YACHENKO, M.V.GALAKHOV, A.F.KOLOMIETS, A.V.FOKIN (1988) Izv.Akad.NaukSSSR(Russ. Lang.): N5, 1196-1196.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6