| SpectraBase Compound ID | GbGe52tEv1L |
|---|---|
| InChI | InChI=1S/C20H23NO5/c1-3-25-16-11-9-15(10-12-16)18(13-19(22)23)21-20(24)14(2)26-17-7-5-4-6-8-17/h4-12,14,18H,3,13H2,1-2H3,(H,21,24)(H,22,23) |
| InChIKey | BVSADQLQFFOEFP-UHFFFAOYSA-N |
| Mol Weight | 357.41 g/mol |
| Molecular Formula | C20H23NO5 |
| Exact Mass | 357.157623 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9bIe8dvCeUy |
|---|---|
| Name | 3-(2-Phenoxypropanoylamino)-3-p-phenetyl-propionic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 357.157622840 u |
| Formula | C20H23NO5 |
| InChI | InChI=1S/C20H23NO5/c1-3-25-16-11-9-15(10-12-16)18(13-19(22)23)21-20(24)14(2)26-17-7-5-4-6-8-17/h4-12,14,18H,3,13H2,1-2H3,(H,21,24)(H,22,23) |
| InChIKey | BVSADQLQFFOEFP-UHFFFAOYSA-N |
| Molecular Weight | 357.406 g/mol |
| SMILES | C=1C=C(C=CC1C(CC(O)=O)NC(=O)C(OC1=CC=CC=C1)C)OCC |