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1,1,1,3-TETRAFLUORO-6-PHENYLHEXAN-2-ONE
SpectraBase Compound ID 1bfXSk2KEjn
InChI InChI=1S/C12H12F4O/c13-10(11(17)12(14,15)16)8-4-7-9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2
InChIKey ZJWMBXPFXFSELY-UHFFFAOYSA-N
Mol Weight 248.22 g/mol
Molecular Formula C12H12F4O
Exact Mass 248.082428 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9OIHqbbTyKR
Name 1,1,1,3-TETRAFLUORO-6-PHENYLHEXAN-2-ONE
Compound Number 18A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12F4O
InChI InChI=1S/C12H12F4O/c13-10(11(17)12(14,15)16)8-4-7-9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2
InChIKey ZJWMBXPFXFSELY-UHFFFAOYSA-N
Literature Reference Author G.KOKOTOS,Y.H.HSU,J.E.BURKE,C.BASKAKIS,C.G.KOKOTOS,V.MAGRIOT I,E.A.DENNIS
Literature Reference Citation J.MED.CHEM.,53,3602(2010)
Literature Reference DOI 10.1021/jm901872v
Solvent CDCl3
Source File Reference UWMZ46016