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(2R)-2-[(benzylthio)methyl]-5-keto-pyrrolidine-1-carboxylic acid tert-butyl ester
SpectraBase Compound ID LtBQVLIHNDA
InChI InChI=1S/C17H23NO3S/c1-17(2,3)21-16(20)18-14(9-10-15(18)19)12-22-11-13-7-5-4-6-8-13/h4-8,14H,9-12H2,1-3H3/t14-/m1/s1
InChIKey YKAGWDCLZRKXSW-CQSZACIVSA-N
Mol Weight 321.44 g/mol
Molecular Formula C17H23NO3S
Exact Mass 321.139865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A6dgJFFeSPy
Name (2R)-2-[(benzylthio)methyl]-5-keto-pyrrolidine-1-carboxylic acid tert-butyl ester
Alternate Name(s) (5R)-2-oxo-5-[(phenylmethylthio)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester tert-Butyl (2R)-2-(benzylsulfanylmethyl)-5-oxo-pyrrolidine-1-carboxylate tert-Butyl (5R)-2-oxidanylidene-5-[(phenylmethylsulfanyl)methyl]pyrrolidine-1-carboxylate
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Formula C17H23NO3S
InChI InChI=1S/C17H23NO3S/c1-17(2,3)21-16(20)18-14(9-10-15(18)19)12-22-11-13-7-5-4-6-8-13/h4-8,14H,9-12H2,1-3H3/t14-/m1/s1
InChIKey YKAGWDCLZRKXSW-CQSZACIVSA-N
Molecular Weight 321.435 g/mol
SMILES C(N1C(CC[C@@]1(CSCc1ccccc1)[H])=O)(OC(C)(C)C)=O
SPLASH splash10-001m-9210000000-eb9533ab0b20c8afa8b8
Source of Spectrum F-53-12873-3
Wiley ID 803804