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ETHYL_3-BENZYLSULFONYLMETHYL-2-CYANO-4,4,5,5,6,6-HEXAFLUORO-2-HEXENOATE
SpectraBase Compound ID 2fRyGkwnE0u
InChI InChI=1S/C17H15F6NO4S/c1-2-28-14(25)12(8-24)13(16(20,21)17(22,23)15(18)19)10-29(26,27)9-11-6-4-3-5-7-11/h3-7,15H,2,9-10H2,1H3/b13-12-
InChIKey HHYYDHGABAOENA-SEYXRHQNSA-N
Mol Weight 443.36 g/mol
Molecular Formula C17H15F6NO4S
Exact Mass 443.062598 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6JQuwYvgtlz
Name ETHYL_3-BENZYLSULFONYLMETHYL-2-CYANO-4,4,5,5,6,6-HEXAFLUORO-2-HEXENOATE
Compound Number IIID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H15F6NO4S
InChI InChI=1S/C17H15F6NO4S/c1-2-28-14(25)12(8-24)13(16(20,21)17(22,23)15(18)19)10-29(26,27)9-11-6-4-3-5-7-11/h3-7,15H,2,9-10H2,1H3/b13-12-
InChIKey HHYYDHGABAOENA-SEYXRHQNSA-N
Literature Reference Author V.M.TIMOSHENKO,Y.G.SHERMOLOVICH
Literature Reference Citation RUSS.J.ORG.CHEM.,38,1538(2002)
Literature Reference DOI 10.1023/A:1022577110263
Solvent C6D6
Source File Reference UWMZ10312