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5,14-Dioxo-5,9,10,14-tetrathia-cis, cis-7,11-octadecadienedioic acid, diethyl ester
SpectraBase Compound ID 8JWDdVVdkj
InChI InChI=1S/C18H30O6S4/c1-3-23-17(19)9-5-13-27(21)15-7-11-25-26-12-8-16-28(22)14-6-10-18(20)24-4-2/h7-8,11-12H,3-6,9-10,13-16H2,1-2H3/b11-7-,12-8-
InChIKey YXPABCDASJPHMQ-OXAWKVHCSA-N
Mol Weight 470.7 g/mol
Molecular Formula C18H30O6S4
Exact Mass 470.092523 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EK3mLXNQmRE
Name 5,14-Dioxo-5,9,10,14-tetrathia-cis, cis-7,11-octadecadienedioic acid, diethyl ester
CAS Registry Number 104324-52-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H30O6S4
InChI InChI=1S/C18H30O6S4/c1-3-23-17(19)9-5-13-27(21)15-7-11-25-26-12-8-16-28(22)14-6-10-18(20)24-4-2/h7-8,11-12H,3-6,9-10,13-16H2,1-2H3/b11-7-,12-8-
InChIKey YXPABCDASJPHMQ-OXAWKVHCSA-N
Instrument Name Bruker WH-90
Literature Reference E. Block, S. Ahmad, J.L. Catalfamo, J. Am. Chem. Soc. 108, 7045 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3