| SpectraBase Compound ID | Hg4RqvehvR |
|---|---|
| InChI | InChI=1S/C13H18BrNO/c1-4-5-6-12(16)15-13-9(2)7-11(14)8-10(13)3/h7-8H,4-6H2,1-3H3,(H,15,16) |
| InChIKey | RWXAELOLLOUEEU-UHFFFAOYSA-N |
| Mol Weight | 284.2 g/mol |
| Molecular Formula | C13H18BrNO |
| Exact Mass | 283.057177 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CFC44XYY7zt |
|---|---|
| Name | N-(4-Bromo-2,6-dimethylphenyl)pentanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 283.057177203 u |
| Formula | C13H18BrNO |
| InChI | InChI=1S/C13H18BrNO/c1-4-5-6-12(16)15-13-9(2)7-11(14)8-10(13)3/h7-8H,4-6H2,1-3H3,(H,15,16) |
| InChIKey | RWXAELOLLOUEEU-UHFFFAOYSA-N |
| SMILES | C1(Br)=CC(=C(C(=C1)C)NC(=O)CCCC)C |