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(E)-2-ETHOXY-1,1,1-TRIFLUORO-6-PHENYL-3-(PHENYLSULFONYL)-HEX-2-EN-5-YN-4-OL

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(E)-2-ETHOXY-1,1,1-TRIFLUORO-6-PHENYL-3-(PHENYLSULFONYL)-HEX-2-EN-5-YN-4-OL
SpectraBase Compound ID IYM4JGrjTBl
InChI InChI=1S/C20H17F3O4S/c1-2-27-19(20(21,22)23)18(28(25,26)16-11-7-4-8-12-16)17(24)14-13-15-9-5-3-6-10-15/h3-12,17,24H,2H2,1H3/b19-18+
InChIKey ZREPJUSPRATWSQ-VHEBQXMUSA-N
Mol Weight 410.41 g/mol
Molecular Formula C20H17F3O4S
Exact Mass 410.079965 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HMzoCiwoMhG
Name (E)-2-ETHOXY-1,1,1-TRIFLUORO-6-PHENYL-3-(PHENYLSULFONYL)-HEX-2-EN-5-YN-4-OL
Compound Number 6D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H17F3O4S
InChI InChI=1S/C20H17F3O4S/c1-2-27-19(20(21,22)23)18(28(25,26)16-11-7-4-8-12-16)17(24)14-13-15-9-5-3-6-10-15/h3-12,17,24H,2H2,1H3/b19-18+
InChIKey ZREPJUSPRATWSQ-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 UWVN4537