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(2E,7S)-7-(1-ETHOXYMETHOXY)-4,4-TRIMETHYLENEDITHIO-2-OCTENOIC-ACID-ETHYLESTER

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(2E,7S)-7-(1-ETHOXYMETHOXY)-4,4-TRIMETHYLENEDITHIO-2-OCTENOIC-ACID-ETHYLESTER
SpectraBase Compound ID 9nCmCBgLq6f
InChI InChI=1S/2C17H30O4S2/c2*1-5-19-15(4)21-14(3)8-10-17(22-12-7-13-23-17)11-9-16(18)20-6-2/h2*9,11,14-15H,5-8,10,12-13H2,1-4H3/b2*11-9+/t2*14-,15?/m11/s1
InChIKey GQAWRVQCFGBMCI-LIPWSJFISA-N
Mol Weight 725.09 g/mol
Molecular Formula C34H60O8S4
Exact Mass 724.317104 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2tNBz8ObznC
Name (2E,7S)-7-(1-ETHOXYMETHOXY)-4,4-TRIMETHYLENEDITHIO-2-OCTENOIC-ACID-ETHYLESTER
Compound Number 10C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H60O8S4
InChI InChI=1S/2C17H30O4S2/c2*1-5-19-15(4)21-14(3)8-10-17(22-12-7-13-23-17)11-9-16(18)20-6-2/h2*9,11,14-15H,5-8,10,12-13H2,1-4H3/b2*11-9+/t2*14-,15?/m11/s1
InChIKey GQAWRVQCFGBMCI-LIPWSJFISA-N
Literature Reference Author B.SEURING,D.SEEBACH
Literature Reference Citation LIEB.ANN.CHEM.,2044(1978)
Molecular Weight 725.086 g/mol
Solvent CDCl3
Source File Reference UWCS11514