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3-(3a,6a-Dimethyl-2,5-dioxo-hexahydro-thieno[2,3-b]pyrrol-4-yl)-propionic acid, methyl ester
SpectraBase Compound ID DRuZolLfPze
InChI InChI=1S/C12H17NO4S/c1-11-6-9(15)18-12(11,2)13-10(16)7(11)4-5-8(14)17-3/h7H,4-6H2,1-3H3,(H,13,16)
InChIKey OFKCAMBZGDHOCS-UHFFFAOYSA-N
Mol Weight 271.33 g/mol
Molecular Formula C12H17NO4S
Exact Mass 271.087829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iy4wkgBxQ9c
Name 3-(3a,6a-Dimethyl-2,5-dioxo-hexahydro-thieno[2,3-b]pyrrol-4-yl)-propionic acid, methyl ester
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Formula C12H17NO4S
InChI InChI=1S/C12H17NO4S/c1-11-6-9(15)18-12(11,2)13-10(16)7(11)4-5-8(14)17-3/h7H,4-6H2,1-3H3,(H,13,16)
InChIKey OFKCAMBZGDHOCS-UHFFFAOYSA-N
Molecular Weight 271.331 g/mol
SMILES N1C2(SC(CC2(C(C1=O)CCC(=O)OC)C)=O)C
SPLASH splash10-00di-7910000000-9feb1893fc6d4c2390b1
Synonyms 3-(2,5-diketo-3a,6a-dimethyl-4,6-dihydro-3H-thieno[2,3-b]pyrrol-4-yl)propionic acid methyl ester 3-(3a,6a-dimethyl-2,5-dioxo-4,6-dihydro-3H-thieno[2,3-b]pyrrol-4-yl)propanoic acid methyl ester Methyl 3-(3a,6a-dimethyl-2,5-dioxo-4,6-dihydro-3H-thieno[2,3-b]pyrrol-4-yl)propanoate Methyl 3-(3a,6a-dimethyl-2,5-dioxohexahydro-2H-thieno[2,3-b]pyrrol-4-yl)propanoate Methyl 3-[3a,6a-dimethyl-2,5-bis(oxidanylidene)-4,6-dihydro-3H-thieno[2,3-b]pyrrol-4-yl]propanoate
Wiley ID 1484964