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5,6-DIHYDRO-2,4-BIS(TRIFLUOROMETHYL)-4-CARBMETHOXY-6-IODOMETHYL-1,3-OXAZINE (DIASTEREOMER 1)
SpectraBase Compound ID DhymvEAKoqT
InChI InChI=1S/C9H8F6INO3/c1-19-6(18)7(9(13,14)15)2-4(3-16)20-5(17-7)8(10,11)12/h4H,2-3H2,1H3
InChIKey RWBFVOWUOMWUJA-UHFFFAOYSA-N
Mol Weight 419.06 g/mol
Molecular Formula C9H8F6INO3
Exact Mass 418.945307 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K3lHFrdEcJ
Name 5,6-DIHYDRO-2,4-BIS(TRIFLUOROMETHYL)-4-CARBMETHOXY-6-IODOMETHYL-1,3-OXAZINE (DIASTEREOMER 1)
Comments MINOR ISOMER. SCALE INVERTED;WP-200SY (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H8F6INO3
InChI InChI=1S/C9H8F6INO3/c1-19-6(18)7(9(13,14)15)2-4(3-16)20-5(17-7)8(10,11)12/h4H,2-3H2,1H3
InChIKey RWBFVOWUOMWUJA-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