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2,3-Bis(ethoxycarbonyl)tetrathiafulvalene
SpectraBase Compound ID LD2IgAjcRgW
InChI InChI=1S/C12H12O4S4/c1-3-15-9(13)7-8(10(14)16-4-2)20-12(19-7)11-17-5-6-18-11/h5-6H,3-4H2,1-2H3
InChIKey NMWXZOKCDSANRB-UHFFFAOYSA-N
Mol Weight 348.5 g/mol
Molecular Formula C12H12O4S4
Exact Mass 347.961844 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4XxtdXCNfaH
Name Diethyl Tetrathiafulvalene-4,5-dicarboxylate
Alternate Name(s) Diethyl [2,2'-bi(1,3-dithiolylidene)]-4,5-dicarboxylate
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Formula C12H12O4S4
InChI InChI=1S/C12H12O4S4/c1-3-15-9(13)7-8(10(14)16-4-2)20-12(19-7)11-17-5-6-18-11/h5-6H,3-4H2,1-2H3
InChIKey NMWXZOKCDSANRB-UHFFFAOYSA-N
Literature Reference DOI 10.1021/acs.orglett.5b02715
Molecular Weight 348.464 g/mol
SMILES C1(SC(=C(S1)C(=O)OCC)C(=O)OCC)=C1SC=CS1
SPLASH splash10-0002-1697000000-d7090b7dd05a0dd8027b
Source of Spectrum A1-17-5356/SM24-7e
Wiley ID 1802598