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(2S,3S)-2-Benzyl-3-hydroxy-pyrrolidine-1-carboxylic acid ethyl ester
SpectraBase Compound ID 1KgV3G5Yn4v
InChI InChI=1S/C14H19NO3/c1-2-18-14(17)15-9-8-13(16)12(15)10-11-6-4-3-5-7-11/h3-7,12-13,16H,2,8-10H2,1H3/t12-,13-/m0/s1
InChIKey WJCBVWNLHYHBLT-STQMWFEESA-N
Mol Weight 249.31 g/mol
Molecular Formula C14H19NO3
Exact Mass 249.136493 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IIP5sa2VSnN
Name (2S,3S)-2-Benzyl-3-hydroxy-pyrrolidine-1-carboxylic acid ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 249.136493473 u
Formula C14H19NO3
InChI InChI=1S/C14H19NO3/c1-2-18-14(17)15-9-8-13(16)12(15)10-11-6-4-3-5-7-11/h3-7,12-13,16H,2,8-10H2,1H3/t12-,13-/m0/s1
InChIKey WJCBVWNLHYHBLT-STQMWFEESA-N
Molecular Weight 249.310 g/mol
SMILES C(N1[C@]([C@@](O)(CC1)[H])(CC1=CC=CC=C1)[H])(=O)OCC