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7-Acetoxy-4,4,9,9,-bis(trimethylene-dithio)-2-decenoic acid, ethyl ester

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7-Acetoxy-4,4,9,9,-bis(trimethylene-dithio)-2-decenoic acid, ethyl ester
SpectraBase Compound ID 9scpRYU7OhE
InChI InChI=1S/C20H32O4S4/c1-4-23-18(22)8-10-20(27-13-6-14-28-20)9-7-17(24-16(2)21)15-19(3)25-11-5-12-26-19/h8,10,17H,4-7,9,11-15H2,1-3H3/b10-8+
InChIKey UPKFDMONCFKDGY-CSKARUKUSA-N
Mol Weight 464.7 g/mol
Molecular Formula C20H32O4S4
Exact Mass 464.118344 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BUjgHSSnjvH
Name 7-Acetoxy-4,4,9,9,-bis(trimethylene-dithio)-2-decenoic acid, ethyl ester
CAS Registry Number 84823-46-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H32O4S4
InChI InChI=1S/C20H32O4S4/c1-4-23-18(22)8-10-20(27-13-6-14-28-20)9-7-17(24-16(2)21)15-19(3)25-11-5-12-26-19/h8,10,17H,4-7,9,11-15H2,1-3H3/b10-8+
InChIKey UPKFDMONCFKDGY-CSKARUKUSA-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