| SpectraBase Compound ID | EguyFcCdh15 |
|---|---|
| InChI | InChI=1S/C12H16ClNO/c1-3-12(14-9(2)15)8-10-4-6-11(13)7-5-10/h4-7,12H,3,8H2,1-2H3,(H,14,15) |
| InChIKey | IQFZKNBFFVFLJO-UHFFFAOYSA-N |
| Mol Weight | 225.72 g/mol |
| Molecular Formula | C12H16ClNO |
| Exact Mass | 225.092042 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 82f62qhB23t |
|---|---|
| Name | 4-cab ac |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 225.092041838 u |
| Formula | C12H16ClNO |
| InChI | InChI=1S/C12H16ClNO/c1-3-12(14-9(2)15)8-10-4-6-11(13)7-5-10/h4-7,12H,3,8H2,1-2H3,(H,14,15) |
| InChIKey | IQFZKNBFFVFLJO-UHFFFAOYSA-N |
| Molecular Weight | 225.719 g/mol |
| SMILES | C(NC(=O)C)(CC=1C=CC(=CC1)Cl)CC |