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(E)-7-(1-Methoxy-ethoxy)-4,4-(trimethylene-dithio)-2-heptenoic acid, methyl ester

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(E)-7-(1-Methoxy-ethoxy)-4,4-(trimethylene-dithio)-2-heptenoic acid, methyl ester
SpectraBase Compound ID L1sU724g0UA
InChI InChI=1S/C14H24O4S2/c1-12(16-2)18-9-4-7-14(8-6-13(15)17-3)19-10-5-11-20-14/h6,8,12H,4-5,7,9-11H2,1-3H3/b8-6+
InChIKey BRKJPHFHPBOLDL-SOFGYWHQSA-N
Mol Weight 320.46 g/mol
Molecular Formula C14H24O4S2
Exact Mass 320.111602 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 98OIB2H6lFw
Name (E)-7-(1-Methoxy-ethoxy)-4,4-(trimethylene-dithio)-2-heptenoic acid, methyl ester
CAS Registry Number 69604-27-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H24O4S2
InChI InChI=1S/C14H24O4S2/c1-12(16-2)18-9-4-7-14(8-6-13(15)17-3)19-10-5-11-20-14/h6,8,12H,4-5,7,9-11H2,1-3H3/b8-6+
InChIKey BRKJPHFHPBOLDL-SOFGYWHQSA-N
Literature Reference B. Seuring, D. Seebach, Liebigs Ann. Chem. 2044 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3