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1,3-Dithietan-2,4-diylidene-bis(malonic acid, diethyl ester)
SpectraBase Compound ID DqueIR8mTA6
InChI InChI=1S/C16H20O8S2/c1-5-21-11(17)9(12(18)22-6-2)15-25-16(26-15)10(13(19)23-7-3)14(20)24-8-4/h5-8H2,1-4H3
InChIKey CQZLSMCISVQUMY-UHFFFAOYSA-N
Mol Weight 404.45 g/mol
Molecular Formula C16H20O8S2
Exact Mass 404.05996 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4JlcG5ZCGAy
Name 1,3-Dithietan-2,4-diylidene-bis(malonic acid, diethyl ester)
CAS Registry Number 7555-16-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H20O8S2
InChI InChI=1S/C16H20O8S2/c1-5-21-11(17)9(12(18)22-6-2)15-25-16(26-15)10(13(19)23-7-3)14(20)24-8-4/h5-8H2,1-4H3
InChIKey CQZLSMCISVQUMY-UHFFFAOYSA-N
Literature Reference R.W. Saalfrank, W. Rost, Angew. Chem. 451 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3