| SpectraBase Compound ID | 6zq9ORDgC69 |
|---|---|
| InChI | InChI=1S/C9H12BrN/c10-6-2-1-4-9-5-3-7-11-8-9/h3,5,7-8H,1-2,4,6H2 |
| InChIKey | SCCVPQAZQJEKSW-UHFFFAOYSA-N |
| Mol Weight | 214.11 g/mol |
| Molecular Formula | C9H12BrN |
| Exact Mass | 213.015312 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2D9zHYi0MRM |
|---|---|
| Name | 3-(4-Bromo-butyl)-pyridine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 213.015312390 u |
| Formula | C9H12BrN |
| InChI | InChI=1S/C9H12BrN/c10-6-2-1-4-9-5-3-7-11-8-9/h3,5,7-8H,1-2,4,6H2 |
| InChIKey | SCCVPQAZQJEKSW-UHFFFAOYSA-N |
| Molecular Weight | 214.106 g/mol |
| SMILES | c1(cnccc1)CCCCBr |