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(E)-3-ETHOXY-1,1,1,2,2-PENTAFLUORO-4-(PHENYLTHIO)-BUT-3-ENE
SpectraBase Compound ID EDWN2aOxS3e
InChI InChI=1S/C12H11F5OS/c1-2-18-10(11(13,14)12(15,16)17)8-19-9-6-4-3-5-7-9/h3-8H,2H2,1H3/b10-8+
InChIKey DERCXIPYCIVDJO-CSKARUKUSA-N
Mol Weight 298.27 g/mol
Molecular Formula C12H11F5OS
Exact Mass 298.045077 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7Zf1P6pAYxw
Name (E)-3-ETHOXY-1,1,1,2,2-PENTAFLUORO-4-(PHENYLTHIO)-BUT-3-ENE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H11F5OS
InChI InChI=1S/C12H11F5OS/c1-2-18-10(11(13,14)12(15,16)17)8-19-9-6-4-3-5-7-9/h3-8H,2H2,1H3/b10-8+
InChIKey DERCXIPYCIVDJO-CSKARUKUSA-N
Literature Reference Author M.YOSHIMATSU,T.SUGIMOTO,N.OKADA,S.KINOSHITA
Literature Reference Citation J.ORG.CHEM.,64,5162(1999)
Literature Reference DOI 10.1021/jo990282p
Molecular Weight 298.271 g/mol
Sample ID 41139
Solvent CDCl3