| SpectraBase Compound ID | A3bExhKdSRN |
|---|---|
| InChI | InChI=1S/C13H18N2O3/c1-3-15(4-2)9-12(16)14-11-7-5-6-10(8-11)13(17)18/h5-8H,3-4,9H2,1-2H3,(H,14,16)(H,17,18) |
| InChIKey | FBPRCFZIFHYLTJ-UHFFFAOYSA-N |
| Mol Weight | 250.3 g/mol |
| Molecular Formula | C13H18N2O3 |
| Exact Mass | 250.131742 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lkcaw57IXl3 |
|---|---|
| Name | 3-(2-(Diethylamino)acetamido)benzoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.131742445 u |
| Formula | C13H18N2O3 |
| InChI | InChI=1S/C13H18N2O3/c1-3-15(4-2)9-12(16)14-11-7-5-6-10(8-11)13(17)18/h5-8H,3-4,9H2,1-2H3,(H,14,16)(H,17,18) |
| InChIKey | FBPRCFZIFHYLTJ-UHFFFAOYSA-N |
| Molecular Weight | 250.298 g/mol |
| SMILES | C(C1=CC(NC(=O)CN(CC)CC)=CC=C1)(=O)O |