| SpectraBase Compound ID | FBKSPDc4TaJ |
|---|---|
| InChI | InChI=1S/C19H21NO3/c1-2-13-23-19(22)17(14-15-9-5-3-6-10-15)20-18(21)16-11-7-4-8-12-16/h3-12,17H,2,13-14H2,1H3,(H,20,21) |
| InChIKey | TZBAHXCUUZTREM-UHFFFAOYSA-N |
| Mol Weight | 311.38 g/mol |
| Molecular Formula | C19H21NO3 |
| Exact Mass | 311.152144 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CHy78HRPE56 |
|---|---|
| Name | Propanoic acid, 2-benzamido-3-phenyl-, propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 311.152143537 u |
| Formula | C19H21NO3 |
| InChI | InChI=1S/C19H21NO3/c1-2-13-23-19(22)17(14-15-9-5-3-6-10-15)20-18(21)16-11-7-4-8-12-16/h3-12,17H,2,13-14H2,1H3,(H,20,21) |
| InChIKey | TZBAHXCUUZTREM-UHFFFAOYSA-N |
| Molecular Weight | 311.381 g/mol |
| SMILES | C(NC(C(=O)OCCC)CC=1C=CC=CC1)(=O)C=1C=CC=CC1 |