| SpectraBase Compound ID | 85CgjHasIaY |
|---|---|
| InChI | InChI=1S/C12H16ClNO/c1-9(2)6-7-14-12(15)10-4-3-5-11(13)8-10/h3-5,8-9H,6-7H2,1-2H3,(H,14,15) |
| InChIKey | WGKDDSBRZJQOJL-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 | FU7r01Qi9cq |
|---|---|
| Name | Benzamide, 3-chloro-N-(3-methylbutyl)- |
| 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/c1-9(2)6-7-14-12(15)10-4-3-5-11(13)8-10/h3-5,8-9H,6-7H2,1-2H3,(H,14,15) |
| InChIKey | WGKDDSBRZJQOJL-UHFFFAOYSA-N |
| Molecular Weight | 225.719 g/mol |
| SMILES | C1=CC=C(C=C1Cl)C(NCCC(C)C)=O |