| SpectraBase Compound ID | A01srhZrlOO |
|---|---|
| InChI | InChI=1S/C12H17NO2/c1-3-10-4-6-11(7-5-10)13-9-8-12(14)15-2/h4-7,13H,3,8-9H2,1-2H3 |
| InChIKey | FFYQKFUSRONJLU-UHFFFAOYSA-N |
| Mol Weight | 207.27 g/mol |
| Molecular Formula | C12H17NO2 |
| Exact Mass | 207.125929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DCDpmj4kxud |
|---|---|
| Name | Methyl 3-(4-ethylanilino)propanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 207.125928789 u |
| Formula | C12H17NO2 |
| InChI | InChI=1S/C12H17NO2/c1-3-10-4-6-11(7-5-10)13-9-8-12(14)15-2/h4-7,13H,3,8-9H2,1-2H3 |
| InChIKey | FFYQKFUSRONJLU-UHFFFAOYSA-N |
| Molecular Weight | 207.273 g/mol |
| SMILES | C(CCNC1=CC=C(C=C1)CC)(=O)OC |