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(2S,4S)-methyl N,1-benzyl-4-(phenylcarbonyloxy)pyrrolidine-2-carboxylate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(2S,4S)-methyl N,1-benzyl-4-(phenylcarbonyloxy)pyrrolidine-2-carboxylate
SpectraBase Compound ID 3qz0YhguJEu
InChI InChI=1S/C20H21NO4/c1-24-20(23)18-12-17(25-19(22)16-10-6-3-7-11-16)14-21(18)13-15-8-4-2-5-9-15/h2-11,17-18H,12-14H2,1H3/t17-,18-/m0/s1
InChIKey CPRDSUQRRHSCRT-ROUUACIJSA-N
Mol Weight 339.39 g/mol
Molecular Formula C20H21NO4
Exact Mass 339.147058 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6VZMpy5S5ov
Name (2S,4S)-Methyl N,1-benzyl-4-(phenylcarbonyloxy)pyrrolidine-2-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 339.147058156 u
Formula C20H21NO4
InChI InChI=1S/C20H21NO4/c1-24-20(23)18-12-17(25-19(22)16-10-6-3-7-11-16)14-21(18)13-15-8-4-2-5-9-15/h2-11,17-18H,12-14H2,1H3/t17-,18-/m0/s1
InChIKey CPRDSUQRRHSCRT-ROUUACIJSA-N
Molecular Weight 339.391 g/mol
SMILES C1[C@@](OC(=O)C2=CC=CC=C2)(C[C@@](C(OC)=O)(N1CC1=CC=CC=C1)[H])[H]