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Methyl 5-tert-butylamino-2-dicyanomethylene-1,3-dithiole-4-carboxylate
SpectraBase Compound ID Jqb4VJaxeIM
InChI InChI=1S/C12H13N3O2S2/c1-12(2,3)15-9-8(10(16)17-4)18-11(19-9)7(5-13)6-14/h15H,1-4H3
InChIKey WJLJQTVBIMDPJA-UHFFFAOYSA-N
Mol Weight 295.38 g/mol
Molecular Formula C12H13N3O2S2
Exact Mass 295.044919 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 24a185bgOW
Name Methyl 5-tert-butylamino-2-dicyanomethylene-1,3-dithiole-4-carboxylate
Alternate Name(s) Methyl 5-(tert-butylamino)-2-(dicyanomethylene)-1,3-dithiole-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N3O2S2
InChI InChI=1S/C12H13N3O2S2/c1-12(2,3)15-9-8(10(16)17-4)18-11(19-9)7(5-13)6-14/h15H,1-4H3
InChIKey WJLJQTVBIMDPJA-UHFFFAOYSA-N
Molecular Weight 295.375 g/mol
SMILES N(C1=C(SC(=C(C#N)C#N)S1)C(=O)OC)C(C)(C)C
SPLASH splash10-0a4j-7290000000-2258a13fc93ed4bb016d
Source of Spectrum F-69-2465-7e
Wiley ID 1737781