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1-Benzoyl-3-hydroxy-3-phenyl-pyrrolidin-2-carboxylic acid, benzyl ester

View entire compound with spectra: 1 NMR

1-Benzoyl-3-hydroxy-3-phenyl-pyrrolidin-2-carboxylic acid, benzyl ester
SpectraBase Compound ID L1yXNE0xGF0
InChI InChI=1S/C25H23NO4/c27-23(20-12-6-2-7-13-20)26-17-16-25(29,21-14-8-3-9-15-21)22(26)24(28)30-18-19-10-4-1-5-11-19/h1-15,22,29H,16-18H2
InChIKey LPNOOYGPWZLCAS-UHFFFAOYSA-N
Mol Weight 401.46 g/mol
Molecular Formula C25H23NO4
Exact Mass 401.162708 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BS84SkKubgs
Name 1-Benzoyl-3-hydroxy-3-phenyl-pyrrolidin-2-carboxylic acid, benzyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 401.162708221 u
Formula C25H23NO4
InChI InChI=1S/C25H23NO4/c27-23(20-12-6-2-7-13-20)26-17-16-25(29,21-14-8-3-9-15-21)22(26)24(28)30-18-19-10-4-1-5-11-19/h1-15,22,29H,16-18H2
InChIKey LPNOOYGPWZLCAS-UHFFFAOYSA-N
Molecular Weight 401.462 g/mol
SMILES C1C(C(C(=O)OCC2=CC=CC=C2)N(C1)C(=O)C1=CC=CC=C1)(C1=CC=CC=C1)O