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1-tert-Butyl-3-(dimethylamino)-4-[.beta..-[[[(ethoxycarbonyl)methyl]amino]-.alpha.-(methoxycarbonyl)-.beta.-(methylthio)vinyl]-2-thiomaleimide
SpectraBase Compound ID Ir2PHYwP4rO
InChI InChI=1S/C19H29N3O5S2/c1-9-27-11(23)10-20-15(29-8)13(18(25)26-7)12-14(21(5)6)17(28)22(16(12)24)19(2,3)4/h20H,9-10H2,1-8H3/b15-13-
InChIKey FEGMLXOLLXYJLR-SQFISAMPSA-N
Mol Weight 443.58 g/mol
Molecular Formula C19H29N3O5S2
Exact Mass 443.154863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9tDW34zrY9k
Name 1-tert-Butyl-3-(dimethylamino)-4-[.beta..-[[[(ethoxycarbonyl)methyl]amino]-.alpha.-(methoxycarbonyl)-.beta.-(methylthio)vinyl]-2-thiomaleimide
Alternate Name(s) Methyl (2Z)-2-[1-tert-butyl-4-(dimethylamino)-2-oxo-5-thioxo-2,5-dihydro-1H-pyrrol-3-yl]-3-[(2-ethoxy-2-oxoethyl)amino]-3-(methylsulfanyl)-2-propenoate
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Formula C19H29N3O5S2
InChI InChI=1S/C19H29N3O5S2/c1-9-27-11(23)10-20-15(29-8)13(18(25)26-7)12-14(21(5)6)17(28)22(16(12)24)19(2,3)4/h20H,9-10H2,1-8H3/b15-13-
InChIKey FEGMLXOLLXYJLR-SQFISAMPSA-N
Molecular Weight 443.577 g/mol
SMILES N(\C(=C/(C=1C(N(C(C)(C)C)C(C1N(C)C)=S)=O)C(=O)OC)SC)CC(=O)OCC
SPLASH splash10-0006-0005900000-32d4b9d9a5eff37bed96
Source of Spectrum F-51-7030-12
Wiley ID 792397