| SpectraBase Compound ID | 22zoYlhLey3 |
|---|---|
| InChI | InChI=1S/C13H18BrNO/c1-10(2)8-15(11(3)16)9-12-4-6-13(14)7-5-12/h4-7,10H,8-9H2,1-3H3 |
| InChIKey | KYGANRZYKOWWNF-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 | 6AUUwj1Ulwv |
|---|---|
| Name | N-(4-Bromobenzyl)-2-methyl-1-propanamine, N-acetyl- |
| 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/c1-10(2)8-15(11(3)16)9-12-4-6-13(14)7-5-12/h4-7,10H,8-9H2,1-3H3 |
| InChIKey | KYGANRZYKOWWNF-UHFFFAOYSA-N |
| SMILES | C1(Br)=CC=C(C=C1)CN(CC(C)C)C(C)=O |