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2-[3-(1,3-benzodithiol-2-ylidenemethyl)benzylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 7SgG7XvupqU
InChI InChI=1S/C22H16O4S4/c1-25-21(23)19-20(22(24)26-2)30-18(29-19)12-14-7-5-6-13(10-14)11-17-27-15-8-3-4-9-16(15)28-17/h3-12H,1-2H3
InChIKey WLSFTIXJIMCCOK-UHFFFAOYSA-N
Mol Weight 472.6 g/mol
Molecular Formula C22H16O4S4
Exact Mass 471.993144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ie5Ht5uXlwH
Name 2-[3-(1,3-benzodithiol-2-ylidenemethyl)benzylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester
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Formula C22H16O4S4
InChI InChI=1S/C22H16O4S4/c1-25-21(23)19-20(22(24)26-2)30-18(29-19)12-14-7-5-6-13(10-14)11-17-27-15-8-3-4-9-16(15)28-17/h3-12H,1-2H3
InChIKey WLSFTIXJIMCCOK-UHFFFAOYSA-N
Molecular Weight 472.606 g/mol
SMILES C1(=C(SC(S1)=Cc1cc(C=C2Sc3ccccc3S2)ccc1)C(=O)OC)C(=O)OC
SPLASH splash10-00di-0010900000-0526892ac6d50e898170
Source of Spectrum O-29-571-2
Synonyms 2-[[3-(1,3-benzodithiol-2-ylidenemethyl)phenyl]methylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Dimethyl 2-[[3-(1,3-benzodithiol-2-ylidenemethyl)phenyl]methylene]-1,3-dithiole-4,5-dicarboxylate Dimethyl 2-[[3-(1,3-benzodithiol-2-ylidenemethyl)phenyl]methylidene]-1,3-dithiole-4,5-dicarboxylate
Wiley ID 1393256