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(E)-3-ETHOXY-1,1,1,2,2-PENTAFLUORO-7-PHENYL-4-(PHENYLSULFONYL)-HEPT-3-EN-6-YN-5-OL

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(E)-3-ETHOXY-1,1,1,2,2-PENTAFLUORO-7-PHENYL-4-(PHENYLSULFONYL)-HEPT-3-EN-6-YN-5-OL
SpectraBase Compound ID EV64M6wlJIu
InChI InChI=1S/C21H17F5O4S/c1-2-30-19(20(22,23)21(24,25)26)18(31(28,29)16-11-7-4-8-12-16)17(27)14-13-15-9-5-3-6-10-15/h3-12,17,27H,2H2,1H3/b19-18+
InChIKey YJMZTDCCFONCAO-VHEBQXMUSA-N
Mol Weight 460.42 g/mol
Molecular Formula C21H17F5O4S
Exact Mass 460.076771 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BkSv9lVvCFP
Name (E)-3-ETHOXY-1,1,1,2,2-PENTAFLUORO-7-PHENYL-4-(PHENYLSULFONYL)-HEPT-3-EN-6-YN-5-OL
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H17F5O4S
InChI InChI=1S/C21H17F5O4S/c1-2-30-19(20(22,23)21(24,25)26)18(31(28,29)16-11-7-4-8-12-16)17(27)14-13-15-9-5-3-6-10-15/h3-12,17,27H,2H2,1H3/b19-18+
InChIKey YJMZTDCCFONCAO-VHEBQXMUSA-N
Literature Reference Author M.YOSHIMATSU,M.HIBINO
Literature Reference Citation CHEM.PHARM.BULL.,48,1395(2000)
Literature Reference DOI 10.1248/cpb.48.1395
Solvent CDCl3
Source File Reference UWVN4540