| SpectraBase Compound ID | ISwxEAywXzO |
|---|---|
| InChI | InChI=1S/C16H17ClN2O2/c1-12-11-13(17)7-8-14(12)21-10-4-6-16(20)19-15-5-2-3-9-18-15/h2-3,5,7-9,11H,4,6,10H2,1H3,(H,18,19,20) |
| InChIKey | HMYKFGJMSKTNJC-UHFFFAOYSA-N |
| Mol Weight | 304.78 g/mol |
| Molecular Formula | C16H17ClN2O2 |
| Exact Mass | 304.097855 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HF1gOQ3YrWj |
|---|---|
| Name | 4-(4-Chloro-2-methylphenoxy)-N-(2-pyridinyl)butanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.097855493 u |
| Formula | C16H17ClN2O2 |
| InChI | InChI=1S/C16H17ClN2O2/c1-12-11-13(17)7-8-14(12)21-10-4-6-16(20)19-15-5-2-3-9-18-15/h2-3,5,7-9,11H,4,6,10H2,1H3,(H,18,19,20) |
| InChIKey | HMYKFGJMSKTNJC-UHFFFAOYSA-N |
| SMILES | N(C(=O)CCCOC=1C(=CC(=CC1)Cl)C)C=1N=CC=CC1 |