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(2S,4R)-4-benzyl-5-keto-pyrrolidine-2-carboxylic acid tert-butyl ester
SpectraBase Compound ID LVroWoFp9Jb
InChI InChI=1S/C16H21NO3/c1-16(2,3)20-15(19)13-10-12(14(18)17-13)9-11-7-5-4-6-8-11/h4-8,12-13H,9-10H2,1-3H3,(H,17,18)/t12-,13+/m1/s1
InChIKey DDWJVHYAWHGDAI-OLZOCXBDSA-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 9mc0CRnpjd1
Name (2S,4R)-4-benzyl-5-keto-pyrrolidine-2-carboxylic acid tert-butyl ester
Alternate Name(s) (2S,4R)-5-oxo-4-(phenylmethyl)-2-pyrrolidinecarboxylic acid tert-butyl ester tert-Butyl (2S,4R)-4-benzyl-5-oxo-pyrrolidine-2-carboxylate tert-Butyl (2S,4R)-5-oxidanylidene-4-(phenylmethyl)pyrrolidine-2-carboxylate
CAS Registry Number 138858-43-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO3
InChI InChI=1S/C16H21NO3/c1-16(2,3)20-15(19)13-10-12(14(18)17-13)9-11-7-5-4-6-8-11/h4-8,12-13H,9-10H2,1-3H3,(H,17,18)/t12-,13+/m1/s1
InChIKey DDWJVHYAWHGDAI-OLZOCXBDSA-N
Molecular Weight 275.348 g/mol
SMILES N1[C@@](C[C@](C1=O)(Cc1ccccc1)[H])(C(OC(C)(C)C)=O)[H]
SPLASH splash10-00mo-9580000000-6c6c8bbc35d75f422c16
Source of Spectrum J-57-1923-7
Wiley ID 1279204