| SpectraBase Compound ID | 7cs72nrR9nR |
|---|---|
| InChI | InChI=1S/C12H16ClNO/c1-9(2)7-8-14-12(15)10-3-5-11(13)6-4-10/h3-6,9H,7-8H2,1-2H3,(H,14,15) |
| InChIKey | OOOBYIKRPVNICF-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 | BJ2wMqByNb3 |
|---|---|
| Name | 4-Chlorobenzamide, 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)7-8-14-12(15)10-3-5-11(13)6-4-10/h3-6,9H,7-8H2,1-2H3,(H,14,15) |
| InChIKey | OOOBYIKRPVNICF-UHFFFAOYSA-N |
| Molecular Weight | 225.719 g/mol |
| SMILES | C1(=CC=C(C=C1)C(NCCC(C)C)=O)Cl |