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6,7,8-TRIEXO-TRICHLORO-3,4-TETRAFLUOROBENZOBICYCLO[3.2.1]OCTEN-2-ONE

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6,7,8-TRIEXO-TRICHLORO-3,4-TETRAFLUOROBENZOBICYCLO[3.2.1]OCTEN-2-ONE
SpectraBase Compound ID CtZ1XbFSj5A
InChI InChI=1S/C12H5Cl3F4O/c13-5-2-1-3(9(17)11(19)10(18)8(1)16)12(20)4(5)7(15)6(2)14/h2,4-7H/t2-,4+,5-,6+,7-/m0/s1
InChIKey PPVRAWCWQLZWPC-HUIMXUKNSA-N
Mol Weight 347.52 g/mol
Molecular Formula C12H5Cl3F4O
Exact Mass 345.934211 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BTmC36tv0aU
Name 6,7,8-TRIEXO-TRICHLORO-3,4-TETRAFLUOROBENZOBICYCLO[3.2.1]OCTEN-2-ONE
Comments CARCAS STRUCTURE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H5Cl3F4O
InChI InChI=1S/C12H5Cl3F4O/c13-5-2-1-3(9(17)11(19)10(18)8(1)16)12(20)4(5)7(15)6(2)14/h2,4-7H/t2-,4+,5-,6+,7-/m0/s1
InChIKey PPVRAWCWQLZWPC-HUIMXUKNSA-N
Instrument Name Varian A56/60A
Literature Reference N.M.SLYN'KO, B.G.DERENDYAEV, M.I.KOLLEGOVA, V.A.BARKHASH (1973)Zhurn.Org.Khim.(Russ. Lang.): v.9, N10, 2058-2068.
NMR Standard C6F6
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3H6O acetone