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(3R,4R)-1-benzyl-5-keto-4-propyl-pyrrolidine-3-carboxylic acid methyl ester
SpectraBase Compound ID 4ltuPLo4c4Y
InChI InChI=1S/C16H21NO3/c1-3-7-13-14(16(19)20-2)11-17(15(13)18)10-12-8-5-4-6-9-12/h4-6,8-9,13-14H,3,7,10-11H2,1-2H3/t13-,14+/m1/s1
InChIKey DINIBAYFBJDVJN-KGLIPLIRSA-N
Mol Weight 275.35 g/mol
Molecular Formula C16H21NO3
Exact Mass 275.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AtRyIQsJTjd
Name (3R,4R)-1-benzyl-5-keto-4-propyl-pyrrolidine-3-carboxylic acid methyl ester
Alternate Name(s) (3R,4R)-5-oxo-1-(phenylmethyl)-4-propyl-3-pyrrolidinecarboxylic acid methyl ester Methyl (3R,4R)-1-benzyl-5-oxo-4-propyl-pyrrolidine-3-carboxylate Methyl (3R,4R)-5-oxidanylidene-1-(phenylmethyl)-4-propyl-pyrrolidine-3-carboxylate
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Formula C16H21NO3
InChI InChI=1S/C16H21NO3/c1-3-7-13-14(16(19)20-2)11-17(15(13)18)10-12-8-5-4-6-9-12/h4-6,8-9,13-14H,3,7,10-11H2,1-2H3/t13-,14+/m1/s1
InChIKey DINIBAYFBJDVJN-KGLIPLIRSA-N
Molecular Weight 275.348 g/mol
SMILES C1(N(C[C@@]([C@]1(CCC)[H])(C(=O)OC)[H])Cc1ccccc1)=O
SPLASH splash10-00dl-5930000000-d18544f280e66e150b35
Source of Spectrum F-55-3955-6
Wiley ID 837249