| SpectraBase Compound ID | 4N81eeGxWmx |
|---|---|
| InChI | InChI=1S/C11H15NO2/c1-8-4-6-10(7-5-8)12-9(2)11(13)14-3/h4-7,9,12H,1-3H3 |
| InChIKey | HMALPGPQEAWBKH-UHFFFAOYSA-N |
| Mol Weight | 193.25 g/mol |
| Molecular Formula | C11H15NO2 |
| Exact Mass | 193.110279 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gd6qOiwan8D |
|---|---|
| Name | Alanine, N-(4-methylphenyl)-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 193.110278725 u |
| Formula | C11H15NO2 |
| InChI | InChI=1S/C11H15NO2/c1-8-4-6-10(7-5-8)12-9(2)11(13)14-3/h4-7,9,12H,1-3H3 |
| InChIKey | HMALPGPQEAWBKH-UHFFFAOYSA-N |
| Molecular Weight | 193.246 g/mol |
| SMILES | C1(=CC=C(C=C1)NC(C)C(OC)=O)C |