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(E)-2-CYANO-1-(4-BROMOPHENYL)-4,4,5,5,5-PENTAFLUORO-1-PENTEN-3-ONE

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(E)-2-CYANO-1-(4-BROMOPHENYL)-4,4,5,5,5-PENTAFLUORO-1-PENTEN-3-ONE
SpectraBase Compound ID HLZLsdXZ9QD
InChI InChI=1S/C12H5BrF5NO/c13-9-3-1-7(2-4-9)5-8(6-19)10(20)11(14,15)12(16,17)18/h1-5H/b8-5+
InChIKey OWBNYBWRAAZQOC-VMPITWQZSA-N
Mol Weight 354.07 g/mol
Molecular Formula C12H5BrF5NO
Exact Mass 352.947468 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1N6CzzxumXc
Name (E)-2-CYANO-1-(4-BROMOPHENYL)-4,4,5,5,5-PENTAFLUORO-1-PENTEN-3-ONE
Compound Number 13C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H5BrF5NO
InChI InChI=1S/C12H5BrF5NO/c13-9-3-1-7(2-4-9)5-8(6-19)10(20)11(14,15)12(16,17)18/h1-5H/b8-5+
InChIKey OWBNYBWRAAZQOC-VMPITWQZSA-N
Literature Reference Author M.YOSHIMATSU,Y.TIMURA
Literature Reference Citation J.ORG.CHEM.,67,5678(2002)
Literature Reference DOI 10.1021/jo0201880
Solvent Unknown
Source File Reference UWSI21656