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(Z)-7-BENZYLOXY-4-N-BUTYL-7-METHYL-1-PHENYL-3-TRIFLUOROMETHYL-3-OCTEN-1,5-DIYNE
SpectraBase Compound ID 9EfvKbzHnMa
InChI InChI=1S/C27H27F3O/c1-4-5-16-24(19-20-26(2,3)31-21-23-14-10-7-11-15-23)25(27(28,29)30)18-17-22-12-8-6-9-13-22/h6-15H,4-5,16,21H2,1-3H3/b25-24-
InChIKey KVGKSAVFECRDRX-IZHYLOQSSA-N
Mol Weight 424.51 g/mol
Molecular Formula C27H27F3O
Exact Mass 424.2014 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GKFP9wK0Sns
Name (Z)-7-BENZYLOXY-4-N-BUTYL-7-METHYL-1-PHENYL-3-TRIFLUOROMETHYL-3-OCTEN-1,5-DIYNE
Compound Number 14B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H27F3O
InChI InChI=1S/C27H27F3O/c1-4-5-16-24(19-20-26(2,3)31-21-23-14-10-7-11-15-23)25(27(28,29)30)18-17-22-12-8-6-9-13-22/h6-15H,4-5,16,21H2,1-3H3/b25-24-
InChIKey KVGKSAVFECRDRX-IZHYLOQSSA-N
Literature Reference Author T.KONNO,M.KISHI,T.ISHIHARA
Literature Reference Citation BEIL.J.ORG.CHEM.,8,2207(2012)
Literature Reference DOI 10.3762/bjoc.8.249
Solvent CDCl3
Source File Reference UWIR10809