| SpectraBase Compound ID | D3XHLT1U7rc |
|---|---|
| InChI | InChI=1S/C13H9BrN2/c14-10-5-3-4-9(8-10)13-15-11-6-1-2-7-12(11)16-13/h1-8H,(H,15,16) |
| InChIKey | KLPQPEGYDCWTKZ-UHFFFAOYSA-N |
| Mol Weight | 273.13 g/mol |
| Molecular Formula | C13H9BrN2 |
| Exact Mass | 271.994911 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3elppM6RKlQ |
|---|---|
| Name | 2-(3-Bromophenyl)-1H-benzimidazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.994911298 u |
| Formula | C13H9BrN2 |
| InChI | InChI=1S/C13H9BrN2/c14-10-5-3-4-9(8-10)13-15-11-6-1-2-7-12(11)16-13/h1-8H,(H,15,16) |
| InChIKey | KLPQPEGYDCWTKZ-UHFFFAOYSA-N |
| SMILES | C1(Br)=CC(=CC=C1)C=1NC2=C(N1)C=CC=C2 |