| SpectraBase Compound ID | 85bq4XUp6iW |
|---|---|
| InChI | InChI=1S/C15H23NO2/c1-3-16(4-2)12-13-18-15(17)11-10-14-8-6-5-7-9-14/h5-9H,3-4,10-13H2,1-2H3 |
| InChIKey | AOEZSVRWNCPDBX-UHFFFAOYSA-N |
| Mol Weight | 249.35 g/mol |
| Molecular Formula | C15H23NO2 |
| Exact Mass | 249.172879 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2d9QQojV53R |
|---|---|
| Name | 3-Phenylpropionic acid, 2-diethylaminoethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 249.172878983 u |
| Formula | C15H23NO2 |
| InChI | InChI=1S/C15H23NO2/c1-3-16(4-2)12-13-18-15(17)11-10-14-8-6-5-7-9-14/h5-9H,3-4,10-13H2,1-2H3 |
| InChIKey | AOEZSVRWNCPDBX-UHFFFAOYSA-N |
| Molecular Weight | 249.354 g/mol |
| SMILES | C(CC1=CC=CC=C1)C(=O)OCCN(CC)CC |