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(3S)-1-ethyl-3-(4-oxotetrahydro-2H-thiopyran-3-yl)pyrrolidine-2,5-dione
SpectraBase Compound ID 2UPj9UASv1d
InChI InChI=1S/C11H15NO3S/c1-2-12-10(14)5-7(11(12)15)8-6-16-4-3-9(8)13/h7-8H,2-6H2,1H3/t7-,8?/m0/s1
InChIKey XXPKTYYFFLHQIE-JAMMHHFISA-N
Mol Weight 241.3 g/mol
Molecular Formula C11H15NO3S
Exact Mass 241.077265 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7614PUFvZfO
Name (3S)-1-ethyl-3-(4-oxotetrahydro-2H-thiopyran-3-yl)pyrrolidine-2,5-dione
Appearance Pale yellow oil
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Formula C11H15NO3S
InChI InChI=1S/C11H15NO3S/c1-2-12-10(14)5-7(11(12)15)8-6-16-4-3-9(8)13/h7-8H,2-6H2,1H3/t7-,8?/m0/s1
InChIKey XXPKTYYFFLHQIE-JAMMHHFISA-N
Instrument Name Agilent 6890N-5973
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202000335
Molecular Weight 241.305 g/mol
Reported Formula C11H15NO3S
SMILES C1(=O)[C@](C2CSCCC2=O)(CC(=O)N1CC)[H]
SPLASH splash10-014i-6900000000-af36b40c98d8de208bb3
Sample Comments diastereomer mixture of syn/anti (60:40)
Source of Spectrum ASC-362-SM74-18df
Wiley ID 1855520