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(3-E,6-E)-3-ETHOXY-1,1,1,2,2-PENTAFLUORO-4-(METHYLTHIO)-7-PHENYLHEPT-3,6-DIEN-5-OL
SpectraBase Compound ID KRk4tDggfNL
InChI InChI=1S/C16H17F5O2S/c1-3-23-14(15(17,18)16(19,20)21)13(24-2)12(22)10-9-11-7-5-4-6-8-11/h4-10,12,22H,3H2,1-2H3/b10-9+,14-13+
InChIKey RUBUUYYSHHKONK-LBSPPQMYSA-N
Mol Weight 368.36 g/mol
Molecular Formula C16H17F5O2S
Exact Mass 368.086942 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Iq7KLGbaIiC
Name (3-E,6-E)-3-ETHOXY-1,1,1,2,2-PENTAFLUORO-4-(METHYLTHIO)-7-PHENYLHEPT-3,6-DIEN-5-OL
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H17F5O2S
InChI InChI=1S/C16H17F5O2S/c1-3-23-14(15(17,18)16(19,20)21)13(24-2)12(22)10-9-11-7-5-4-6-8-11/h4-10,12,22H,3H2,1-2H3/b10-9+,14-13+
InChIKey RUBUUYYSHHKONK-LBSPPQMYSA-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 368.362 g/mol
Sample ID 41151
Solvent CDCl3