| SpectraBase Compound ID | CokfYmRuIDI |
|---|---|
| InChI | InChI=1S/C12H17NO2/c1-9-3-5-11(6-4-9)12(15)7-8-13-10(2)14/h3-6,12,15H,7-8H2,1-2H3,(H,13,14) |
| InChIKey | GRKDCEIIEPWXQD-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 | 6QAKLXfbBIA |
|---|---|
| Name | N-(3-Hydroxy-3-p-tolylpropyl)acetamide |
| 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/c1-9-3-5-11(6-4-9)12(15)7-8-13-10(2)14/h3-6,12,15H,7-8H2,1-2H3,(H,13,14) |
| InChIKey | GRKDCEIIEPWXQD-UHFFFAOYSA-N |
| Molecular Weight | 207.273 g/mol |
| SMILES | C(C)(=O)NCCC(C=1C=CC(=CC1)C)O |