| SpectraBase Compound ID | IliqKfOSL99 |
|---|---|
| InChI | InChI=1S/C10H13NO2/c1-3-11-9-6-4-8(5-7-9)10(12)13-2/h4-7,11H,3H2,1-2H3 |
| InChIKey | QNRGFOGJMSRYIH-UHFFFAOYSA-N |
| Mol Weight | 179.22 g/mol |
| Molecular Formula | C10H13NO2 |
| Exact Mass | 179.094629 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Il2IfhiFRI5 |
|---|---|
| Name | Benzoic acid, 4-(ethylamino)-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 179.094628661 u |
| Formula | C10H13NO2 |
| InChI | InChI=1S/C10H13NO2/c1-3-11-9-6-4-8(5-7-9)10(12)13-2/h4-7,11H,3H2,1-2H3 |
| InChIKey | QNRGFOGJMSRYIH-UHFFFAOYSA-N |
| Molecular Weight | 179.219 g/mol |
| SMILES | C1=CC(=CC=C1C(OC)=O)NCC |