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Dimethyl 2-thioxo-1,3-dithiolo[4,5-b]dithiin-5,6-dicarboxylate
SpectraBase Compound ID 7SB9WMcTKwV
InChI InChI=1S/C9H6O4S5/c1-12-5(10)3-4(6(11)13-2)16-8-7(15-3)17-9(14)18-8/h1-2H3
InChIKey AJFCJODELNDPJS-UHFFFAOYSA-N
Mol Weight 338.4 g/mol
Molecular Formula C9H6O4S5
Exact Mass 337.886965 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L3pSGtIRPF1
Name Dimethyl 2-thioxo-1,3-dithiolo[4,5-b]dithiin-5,6-dicarboxylate
Alternate Name(s) dimethyl 2-thioxo[1,3]dithiolo[4,5-b][1,4]dithiin-5,6-dicarboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C9H6O4S5
InChI InChI=1S/C9H6O4S5/c1-12-5(10)3-4(6(11)13-2)16-8-7(15-3)17-9(14)18-8/h1-2H3
InChIKey AJFCJODELNDPJS-UHFFFAOYSA-N
Molecular Weight 338.443 g/mol
SMILES C1(=C(SC2=C(S1)SC(=S)S2)C(=O)OC)C(=O)OC
SPLASH splash10-000i-9007000000-0050502afb5ad8c17f32
Source of Spectrum F-50-11211-10
Wiley ID 789504