| SpectraBase Compound ID | 5j3BtKzkLep |
|---|---|
| InChI | InChI=1S/C14H17Br/c1-2-3-4-5-6-7-8-13-9-11-14(15)12-10-13/h9-12H,2-6H2,1H3 |
| InChIKey | ZMKNQFUPVRRNGB-UHFFFAOYSA-N |
| Mol Weight | 265.19 g/mol |
| Molecular Formula | C14H17Br |
| Exact Mass | 264.051364 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FAHIdseoW70 |
|---|---|
| Name | 1-Bromo-4-(oct-1-ynyl)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.051363547 u |
| Formula | C14H17Br |
| InChI | InChI=1S/C14H17Br/c1-2-3-4-5-6-7-8-13-9-11-14(15)12-10-13/h9-12H,2-6H2,1H3 |
| InChIKey | ZMKNQFUPVRRNGB-UHFFFAOYSA-N |
| Molecular Weight | 265.194 g/mol |
| SMILES | C=1(C=CC(=CC1)C#CCCCCCC)Br |