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E-ETHYL-2-BENZYLIDENE-3-OXO-4,4,5,5,6,6,7,7-OCTAFLUOROHEPTANOATE;MAJOR_ISOMER
SpectraBase Compound ID IzDbtw4MT7s
InChI InChI=1S/C16H12F8O3/c1-2-27-12(26)10(8-9-6-4-3-5-7-9)11(25)14(19,20)16(23,24)15(21,22)13(17)18/h3-8,13H,2H2,1H3/b10-8+
InChIKey UUDQFJNWZVKBJI-CSKARUKUSA-N
Mol Weight 404.26 g/mol
Molecular Formula C16H12F8O3
Exact Mass 404.06587 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KFNFeV1DYq
Name E-ETHYL-2-BENZYLIDENE-3-OXO-4,4,5,5,6,6,7,7-OCTAFLUOROHEPTANOATE;MAJOR_ISOMER
Compound Number IID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H12F8O3
InChI InChI=1S/C16H12F8O3/c1-2-27-12(26)10(8-9-6-4-3-5-7-9)11(25)14(19,20)16(23,24)15(21,22)13(17)18/h3-8,13H,2H2,1H3/b10-8+
InChIKey UUDQFJNWZVKBJI-CSKARUKUSA-N
Literature Reference Author M.V.PRYADEINA,O.G.KUZUEVA,Y.V.BURGART,V.I.SALOUTIN
Literature Reference Citation RUSS.J.ORG.CHEM.,38,224(2002)
Literature Reference DOI 10.1023/A:1015565700648
Solvent CDCl3
Source File Reference UWMZ10177