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3-(2-Sulfanylidene-1-pyrrolidinyl)hexanoic acid ethyl ester
SpectraBase Compound ID 5D36Go2xaYr
InChI InChI=1S/C12H21NO2S/c1-3-6-10(9-12(14)15-4-2)13-8-5-7-11(13)16/h10H,3-9H2,1-2H3
InChIKey LQSHBNFGFZXVKE-UHFFFAOYSA-N
Mol Weight 243.36 g/mol
Molecular Formula C12H21NO2S
Exact Mass 243.1293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID f5V0DNAKSt
Name 3-(2-Sulfanylidene-1-pyrrolidinyl)hexanoic acid ethyl ester
Alternate Name(s) 3-(2-Thioxopyrrolidino)hexanoic acid ethyl ester Ethyl 3-(2-sulfanylidenepyrrolidin-1-yl)hexanoate Ethyl 3-(2-thioxopyrrolidin-1-yl)hexanoate
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Formula C12H21NO2S
InChI InChI=1S/C12H21NO2S/c1-3-6-10(9-12(14)15-4-2)13-8-5-7-11(13)16/h10H,3-9H2,1-2H3
InChIKey LQSHBNFGFZXVKE-UHFFFAOYSA-N
Molecular Weight 243.365 g/mol
SMILES C1(N(CCC1)C(CC(=O)OCC)CCC)=S
SPLASH splash10-0ufr-2930000000-b80dfab5f6d9b4536cca
Source of Spectrum U1-1998-868-7
Wiley ID 751227