| SpectraBase Compound ID | IQcQD8a7t6H |
|---|---|
| InChI | InChI=1S/C13H19NO2/c1-3-14(4-2)10-11-16-13(15)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3 |
| InChIKey | GEVPHAFTDXTZHY-UHFFFAOYSA-N |
| Mol Weight | 221.3 g/mol |
| Molecular Formula | C13H19NO2 |
| Exact Mass | 221.141579 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AQat1HavitK |
|---|---|
| Name | Benzoic acid, 2-(diethylamino)ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 221.141578854 u |
| Formula | C13H19NO2 |
| InChI | InChI=1S/C13H19NO2/c1-3-14(4-2)10-11-16-13(15)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3 |
| InChIKey | GEVPHAFTDXTZHY-UHFFFAOYSA-N |
| Molecular Weight | 221.300 g/mol |
| SMILES | C1=CC(C(OCCN(CC)CC)=O)=CC=C1 |