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

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(E)-4-ACETOXY-2-ETHOXY-1,1,1-TRIFLUORO-6-PHENYL-3-(PHENYLSULFONYL)-HEX-2-EN-5-YNE
SpectraBase Compound ID 5RUlr2EnH0n
InChI InChI=1S/C22H19F3O5S/c1-3-29-21(22(23,24)25)20(31(27,28)18-12-8-5-9-13-18)19(30-16(2)26)15-14-17-10-6-4-7-11-17/h4-13,19H,3H2,1-2H3/b21-20+
InChIKey ARUKLOUVHMERJS-QZQOTICOSA-N
Mol Weight 452.44 g/mol
Molecular Formula C22H19F3O5S
Exact Mass 452.090529 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 127156ZkjHB
Name (E)-4-ACETOXY-2-ETHOXY-1,1,1-TRIFLUORO-6-PHENYL-3-(PHENYLSULFONYL)-HEX-2-EN-5-YNE
Compound Number 7D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H19F3O5S
InChI InChI=1S/C22H19F3O5S/c1-3-29-21(22(23,24)25)20(31(27,28)18-12-8-5-9-13-18)19(30-16(2)26)15-14-17-10-6-4-7-11-17/h4-13,19H,3H2,1-2H3/b21-20+
InChIKey ARUKLOUVHMERJS-QZQOTICOSA-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 UWVN4544