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(E)-6-BENZYLOXY-1,1,1-TRIFLUORO-2-IODO-6-METHYL-3-PARA-METHOXYPHENYL-2-HEPTEN-4-YNE
SpectraBase Compound ID 57vn2fTUjwI
InChI InChI=1S/C22H20F3IO2/c1-21(2,28-15-16-7-5-4-6-8-16)14-13-19(20(26)22(23,24)25)17-9-11-18(27-3)12-10-17/h4-12H,15H2,1-3H3/b20-19-
InChIKey CECHWWSAHSVRLO-VXPUYCOJSA-N
Mol Weight 500.3 g/mol
Molecular Formula C22H20F3IO2
Exact Mass 500.046009 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lu7Fsva4lwC
Name (E)-6-BENZYLOXY-1,1,1-TRIFLUORO-2-IODO-6-METHYL-3-PARA-METHOXYPHENYL-2-HEPTEN-4-YNE
Compound Number 13E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H20F3IO2
InChI InChI=1S/C22H20F3IO2/c1-21(2,28-15-16-7-5-4-6-8-16)14-13-19(20(26)22(23,24)25)17-9-11-18(27-3)12-10-17/h4-12H,15H2,1-3H3/b20-19-
InChIKey CECHWWSAHSVRLO-VXPUYCOJSA-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 UWIR10807