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2,2'-(2-Nitrosoethanediylidene)bis(4,5-dicarbomethoxy-1,3-dithiole)
SpectraBase Compound ID DPaIWoi7oMm
InChI InChI=1S/C16H13NO9S4/c1-23-12(18)8-9(13(19)24-2)28-7(27-8)5-6(17-22)16-29-10(14(20)25-3)11(30-16)15(21)26-4/h5H,1-4H3
InChIKey XZQOBVJQWZPIBO-UHFFFAOYSA-N
Mol Weight 491.5 g/mol
Molecular Formula C16H13NO9S4
Exact Mass 490.947316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KSMxMThwZtX
Name 2,2'-(2-Nitrosoethanediylidene)bis(4,5-dicarbomethoxy-1,3-dithiole)
Alternate Name(s) Dimethyl 2-{2-[4,5-bis(methoxycarbonyl)-1,3-dithiol-2-ylidene]-1-nitrosoethylidene}-1,3-dithiole-4,5-dicarboxylate 2-[2-[4,5-bis(methoxycarbonyl)-1,3-dithiol-2-ylidene]-2-nitrosoethylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Dimethyl 2-[2-[4,5-bis(methoxycarbonyl)-1,3-dithiol-2-ylidene]-2-nitrosoethylidene]-1,3-dithiole-4,5-dicarboxylate Dimethyl 2-[2-[4,5-bis(methoxycarbonyl)-1,3-dithiol-2-ylidene]-2-nitroso-ethylidene]-1,3-dithiole-4,5-dicarboxylate
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Formula C16H13NO9S4
InChI InChI=1S/C16H13NO9S4/c1-23-12(18)8-9(13(19)24-2)28-7(27-8)5-6(17-22)16-29-10(14(20)25-3)11(30-16)15(21)26-4/h5H,1-4H3
InChIKey XZQOBVJQWZPIBO-UHFFFAOYSA-N
Molecular Weight 491.518 g/mol
SMILES C1(=C(SC(S1)=C(C=C1SC(C(=O)OC)=C(S1)C(=O)OC)N=O)C(=O)OC)C(=O)OC
SPLASH splash10-0a4i-0090000000-e8138695d1dfcbf3d95d
Source of Spectrum J-62-2618-3
Wiley ID 1397379