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(3S,4R)-1-benzyl-4-butyl-5-keto-pyrrolidine-3-carboxylic acid methyl ester
SpectraBase Compound ID CvXGBYGbgMo
InChI InChI=1S/C17H23NO3/c1-3-4-10-14-15(17(20)21-2)12-18(16(14)19)11-13-8-6-5-7-9-13/h5-9,14-15H,3-4,10-12H2,1-2H3/t14-,15-/m1/s1
InChIKey PRSSFTZPIVOZNC-HUUCEWRRSA-N
Mol Weight 289.38 g/mol
Molecular Formula C17H23NO3
Exact Mass 289.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4udwSKNOhk
Name (3S,4R)-1-benzyl-4-butyl-5-keto-pyrrolidine-3-carboxylic acid methyl ester
Alternate Name(s) (3S,4R)-4-butyl-5-oxo-1-(phenylmethyl)-3-pyrrolidinecarboxylic acid methyl ester Methyl (3S,4R)-1-benzyl-4-butyl-5-oxo-pyrrolidine-3-carboxylate Methyl (3S,4R)-4-butyl-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxylate
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Formula C17H23NO3
InChI InChI=1S/C17H23NO3/c1-3-4-10-14-15(17(20)21-2)12-18(16(14)19)11-13-8-6-5-7-9-13/h5-9,14-15H,3-4,10-12H2,1-2H3/t14-,15-/m1/s1
InChIKey PRSSFTZPIVOZNC-HUUCEWRRSA-N
Molecular Weight 289.375 g/mol
SMILES C1(N(C[C@]([C@]1(CCCC)[H])(C(=O)OC)[H])Cc1ccccc1)=O
SPLASH splash10-00dl-8930000000-905435fa08ee50ae4c29
Source of Spectrum F-55-3956-6
Wiley ID 837245