| SpectraBase Compound ID | 6Hiq5baEyU1 |
|---|---|
| InChI | InChI=1S/C13H17NO3/c15-9-12-7-4-8-14(12)13(16)17-10-11-5-2-1-3-6-11/h1-3,5-6,12,15H,4,7-10H2/t12-/m1/s1 |
| InChIKey | BJTNHGVCFWDNDP-GFCCVEGCSA-N |
| Mol Weight | 235.28 g/mol |
| Molecular Formula | C13H17NO3 |
| Exact Mass | 235.120843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IRnTtbXhzuT |
|---|---|
| Name | (2R)-2-(Hydroxymethyl)-1-pyrrolidinecarboxylic acid (phenylmethyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.120843408 u |
| Formula | C13H17NO3 |
| InChI | InChI=1S/C13H17NO3/c15-9-12-7-4-8-14(12)13(16)17-10-11-5-2-1-3-6-11/h1-3,5-6,12,15H,4,7-10H2/t12-/m1/s1 |
| InChIKey | BJTNHGVCFWDNDP-GFCCVEGCSA-N |
| Molecular Weight | 235.283 g/mol |
| SMILES | C(N1[C@@](CO)(CCC1)[H])(OCC1=CC=CC=C1)=O |