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7-CHLORO-4-FLUORO-2-PENTAFLUOROETHYL-3-TRIFLUOROMETHYL-1,5-BENZOXAZEPINE
SpectraBase Compound ID GvIcosExw3z
InChI InChI=1S/C12H3ClF9NO/c13-4-1-2-6-5(3-4)23-9(14)7(11(17,18)19)8(24-6)10(15,16)12(20,21)22/h1-3H
InChIKey AIFQOZNMBDLMFA-UHFFFAOYSA-N
Mol Weight 383.6 g/mol
Molecular Formula C12H3ClF9NO
Exact Mass 382.975945 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fjw4SjODMTH
Name 7-CHLORO-4-FLUORO-2-PENTAFLUOROETHYL-3-TRIFLUOROMETHYL-1,5-BENZOXAZEPINE
Comments SCALE INVERTED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H3ClF9NO
InChI InChI=1S/C12H3ClF9NO/c13-4-1-2-6-5(3-4)23-9(14)7(11(17,18)19)8(24-6)10(15,16)12(20,21)22/h1-3H
InChIKey AIFQOZNMBDLMFA-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference M.MARUTA, S.KUBOTA, N.YOSHIMURA, T.KITAZUME, N.ISHIKAWA (1980) J.Fluor.Chem.:v.16, N1, 75-88.
NMR Standard CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported