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(2E,5E)-2-ETHOXY-1,1,1-TRIFLUORO-6-PHENYL-3-(PHENYLSULFONYL)-HEX-2,5-DIEN-4-OL
SpectraBase Compound ID Kr6kjecLgwb
InChI InChI=1S/C20H19F3O4S/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/h3-14,17,24H,2H2,1H3/b14-13+,19-18+
InChIKey IWUZFNWXRLPIAO-CDSOMVEVSA-N
Mol Weight 412.42 g/mol
Molecular Formula C20H19F3O4S
Exact Mass 412.095615 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7DzeYcWsxPq
Name (2E,5E)-2-ETHOXY-1,1,1-TRIFLUORO-6-PHENYL-3-(PHENYLSULFONYL)-HEX-2,5-DIEN-4-OL
Compound Number 5F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H19F3O4S
InChI InChI=1S/C20H19F3O4S/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/h3-14,17,24H,2H2,1H3/b14-13+,19-18+
InChIKey IWUZFNWXRLPIAO-CDSOMVEVSA-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
Molecular Weight 412.424 g/mol
Solvent CDCl3
Source File Reference UWVN4538