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

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(2E,7S)-7-(1-METHOXYETHOXY)-4,4-TRIMETHYLENEDITHIO-2-OCTENOIC-ACID-ETHYLESTER
SpectraBase Compound ID 6IsNdYRc84
InChI InChI=1S/2C16H28O4S2/c2*1-5-19-15(17)8-10-16(21-11-6-12-22-16)9-7-13(2)20-14(3)18-4/h2*8,10,13-14H,5-7,9,11-12H2,1-4H3/b2*10-8+/t2*13-,14?/m11/s1
InChIKey LKBGYLHKEOANJV-WHROPFOYSA-N
Mol Weight 697.03 g/mol
Molecular Formula C32H56O8S4
Exact Mass 696.285803 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ECf86LwGsgd
Name (2E,7S)-7-(1-METHOXYETHOXY)-4,4-TRIMETHYLENEDITHIO-2-OCTENOIC-ACID-ETHYLESTER
Compound Number 10D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H56O8S4
InChI InChI=1S/2C16H28O4S2/c2*1-5-19-15(17)8-10-16(21-11-6-12-22-16)9-7-13(2)20-14(3)18-4/h2*8,10,13-14H,5-7,9,11-12H2,1-4H3/b2*10-8+/t2*13-,14?/m11/s1
InChIKey LKBGYLHKEOANJV-WHROPFOYSA-N
Literature Reference Author B.SEURING,D.SEEBACH
Literature Reference Citation LIEB.ANN.CHEM.,2044(1978)
Molecular Weight 697.032 g/mol
Solvent CDCl3
Source File Reference UWCS11515