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1-Pyrrolidinethioic acid, 2-[2,2-bis(methoxycarbonyl)ethyl]-, S-methyl ester
SpectraBase Compound ID 8JsWALXAmqU
InChI InChI=1S/C12H19NO5S/c1-17-10(14)9(11(15)18-2)7-8-5-4-6-13(8)12(16)19-3/h8-9H,4-7H2,1-3H3
InChIKey VZMSCAFSEOLGNY-UHFFFAOYSA-N
Mol Weight 289.35 g/mol
Molecular Formula C12H19NO5S
Exact Mass 289.098394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ILMCjy3Vjgg
Name 1-Pyrrolidinethioic acid, 2-[2,2-bis(methoxycarbonyl)ethyl]-, S-methyl ester
Alternate Name(s) 2-[[1-(methylthio)carbonylpyrrolidin-2-yl]methyl]malonic acid dimethyl ester 2-[[1-[(methylthio)-oxomethyl]-2-pyrrolidinyl]methyl]propanedioic acid dimethyl ester Dimethyl 2-((1-[(methylsulfanyl)carbonyl]-2-pyrrolidinyl)methyl)malonate Dimethyl 2-[(1-methylsulfanylcarbonylpyrrolidin-2-yl)methyl]propanedioate
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Formula C12H19NO5S
InChI InChI=1S/C12H19NO5S/c1-17-10(14)9(11(15)18-2)7-8-5-4-6-13(8)12(16)19-3/h8-9H,4-7H2,1-3H3
InChIKey VZMSCAFSEOLGNY-UHFFFAOYSA-N
Molecular Weight 289.346 g/mol
SMILES C1CC(N(C1)C(=O)SC)CC(C(=O)OC)C(=O)OC
SPLASH splash10-06wc-5930000000-e73af90e90271eb724eb
Wiley ID 1478062