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dimethyl 2-[2-[4,5-bis(methoxycarbonyl)-1,3-dithiol-2-ylidene]ethylidene]-1,3-dithiole-4,5-dicarboxylate
SpectraBase Compound ID K1bnJ3EN9Xe
InChI InChI=1S/C16H14O8S4/c1-21-13(17)9-10(14(18)22-2)26-7(25-9)5-6-8-27-11(15(19)23-3)12(28-8)16(20)24-4/h5-6H,1-4H3
InChIKey KFRBGKGGJDDNKT-UHFFFAOYSA-N
Mol Weight 462.5 g/mol
Molecular Formula C16H14O8S4
Exact Mass 461.957152 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3yyxseUXyRe
Name dimethyl 2-[2-[4,5-bis(methoxycarbonyl)-1,3-dithiol-2-ylidene]ethylidene]-1,3-dithiole-4,5-dicarboxylate
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Formula C16H14O8S4
InChI InChI=1S/C16H14O8S4/c1-21-13(17)9-10(14(18)22-2)26-7(25-9)5-6-8-27-11(15(19)23-3)12(28-8)16(20)24-4/h5-6H,1-4H3
InChIKey KFRBGKGGJDDNKT-UHFFFAOYSA-N
Instrument Name VG Analytical-Autospec EBE
Ionization Type EI
Literature Reference DOI 10.1002/rcm.1290090928
Molecular Weight 462.520 g/mol
SMILES COC(=O)C1=C(C(OC)=O)SC(S1)=CC=C1SC(=C(S1)C(OC)=O)C(=O)OC
SPLASH splash10-03di-2220900000-b42a85326684cb689720
Source of Spectrum RCM-9-857-2a
Wiley ID 1835927