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(2E,7S)-7-(1-METHOXYETHOXY)-4,4-TRIMETHYLENEDITHIO-2-OCTENOIC-ACID-METHYLESTER

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(2E,7S)-7-(1-METHOXYETHOXY)-4,4-TRIMETHYLENEDITHIO-2-OCTENOIC-ACID-METHYLESTER
SpectraBase Compound ID H8L7nXtW5xy
InChI InChI=1S/2C15H26O4S2/c2*1-12(19-13(2)17-3)6-8-15(9-7-14(16)18-4)20-10-5-11-21-15/h2*7,9,12-13H,5-6,8,10-11H2,1-4H3/b2*9-7+
InChIKey AHYICAPFHAZOBJ-ADRHZMIWSA-N
Mol Weight 668.98 g/mol
Molecular Formula C30H52O8S4
Exact Mass 668.254503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3kqZgDd05Bx
Name (2E,7S)-7-(1-METHOXYETHOXY)-4,4-TRIMETHYLENEDITHIO-2-OCTENOIC-ACID-METHYLESTER
Compound Number 10A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H52O8S4
InChI InChI=1S/2C15H26O4S2/c2*1-12(19-13(2)17-3)6-8-15(9-7-14(16)18-4)20-10-5-11-21-15/h2*7,9,12-13H,5-6,8,10-11H2,1-4H3/b2*9-7+
InChIKey AHYICAPFHAZOBJ-ADRHZMIWSA-N
Literature Reference Author B.SEURING,D.SEEBACH
Literature Reference Citation LIEB.ANN.CHEM.,2044(1978)
Molecular Weight 668.978 g/mol
Solvent CDCl3
Source File Reference UWCS11512