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1-[3,3,4,4,5,5,5-HEPTAFLUORO-(1E)-PENTENYL]-HEPTYL-BENZOATE
SpectraBase Compound ID 6O7jPvtEWPh
InChI InChI=1S/C19H21F7O2/c1-2-3-4-8-11-15(28-16(27)14-9-6-5-7-10-14)12-13-17(20,21)18(22,23)19(24,25)26/h5-7,9-10,12-13,15H,2-4,8,11H2,1H3/b13-12+
InChIKey LJXULCOILWUTKF-OUKQBFOZSA-N
Mol Weight 414.36 g/mol
Molecular Formula C19H21F7O2
Exact Mass 414.142977 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Eam7GCfNkU7
Name 1-[3,3,4,4,5,5,5-HEPTAFLUORO-(1E)-PENTENYL]-HEPTYL-BENZOATE
Compound Number 5J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H21F7O2
InChI InChI=1S/C19H21F7O2/c1-2-3-4-8-11-15(28-16(27)14-9-6-5-7-10-14)12-13-17(20,21)18(22,23)19(24,25)26/h5-7,9-10,12-13,15H,2-4,8,11H2,1H3/b13-12+
InChIKey LJXULCOILWUTKF-OUKQBFOZSA-N
Literature Reference Author T.KONNO,K.NAGATA,T.ISHIHARA,H.YAMANAKA
Literature Reference Citation J.ORG.CHEM.,67,1768(2002)
Literature Reference DOI 10.1021/jo011013d
Solvent CDCl3
Source File Reference UWLU24999