| SpectraBase Compound ID | AVG966N0myS |
|---|---|
| InChI | InChI=1S/C13H15NO4/c15-10-7-11(13(17)18)14(8-10)12(16)6-9-4-2-1-3-5-9/h1-5,10-11,15H,6-8H2,(H,17,18)/t10?,11-/m0/s1 |
| InChIKey | WPONTCDDMQZRMY-DTIOYNMSSA-N |
| Mol Weight | 249.27 g/mol |
| Molecular Formula | C13H15NO4 |
| Exact Mass | 249.100108 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 6e7y8PIor76 |
|---|---|
| Name | L-4-Hydroxy-1-(phenylacetyl)proline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 249.100107963 u |
| Formula | C13H15NO4 |
| InChI | InChI=1S/C13H15NO4/c15-10-7-11(13(17)18)14(8-10)12(16)6-9-4-2-1-3-5-9/h1-5,10-11,15H,6-8H2,(H,17,18)/t10?,11-/m0/s1 |
| InChIKey | WPONTCDDMQZRMY-DTIOYNMSSA-N |
| Molecular Weight | 249.266 g/mol |
| SMILES | OC1CN([C@](C(=O)O)(C1)[H])C(CC1=CC=CC=C1)=O |