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2-EXO-BROMO-8-ANTI-HYDROXY-6,7-TETRAFLUOROBENZOBICYCLO[3.2.1]OCTENE
SpectraBase Compound ID I6BW6XZ5M4f
InChI InChI=1S/C12H9BrF4O/c13-4-2-1-3-5-7(6(4)12(3)18)9(15)11(17)10(16)8(5)14/h3-4,6,12,18H,1-2H2/t3-,4-,6+,12-/m0/s1
InChIKey NNHKHYQBZSCQLF-IOESDYCRSA-N
Mol Weight 325.1 g/mol
Molecular Formula C12H9BrF4O
Exact Mass 323.977291 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3dcNO9fx1rc
Name 2-EXO-BROMO-8-ANTI-HYDROXY-6,7-TETRAFLUOROBENZOBICYCLO[3.2.1]OCTENE
Comments CARCAS STRUCTURE. SCALE INVERTED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H9BrF4O
InChI InChI=1S/C12H9BrF4O/c13-4-2-1-3-5-7(6(4)12(3)18)9(15)11(17)10(16)8(5)14/h3-4,6,12,18H,1-2H2/t3-,4-,6+,12-/m0/s1
InChIKey NNHKHYQBZSCQLF-IOESDYCRSA-N
Instrument Name Varian A56/60A
Literature Reference N.N.POVOLOTSKAYA, A.YU.SPIVAK, G.D.SLYN'KO, M.I.KOLLEGOVA, B.G.DERENDYAEV,A.K.PETROV, V.A.BARKHASH (1973) Zhurn.Org.Khim.(Russ. Lang.): v.9, N9, 1869-1878.
NMR Standard C6F6
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported