| SpectraBase Compound ID | HjGhsKdimAi |
|---|---|
| InChI | InChI=1S/C20H14Br2N2/c21-16-7-3-5-14(11-16)13-24-19-10-2-1-9-18(19)23-20(24)15-6-4-8-17(22)12-15/h1-12H,13H2 |
| InChIKey | HPLYIZZNQKEBOW-UHFFFAOYSA-N |
| Mol Weight | 442.15 g/mol |
| Molecular Formula | C20H14Br2N2 |
| Exact Mass | 439.952374 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FPUiosH64Pb |
|---|---|
| Name | 1-(3-Bromobenzyl)-2-(3-bromophenyl)benzimidazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 439.952374459 u |
| Formula | C20H14Br2N2 |
| InChI | InChI=1S/C20H14Br2N2/c21-16-7-3-5-14(11-16)13-24-19-10-2-1-9-18(19)23-20(24)15-6-4-8-17(22)12-15/h1-12H,13H2 |
| InChIKey | HPLYIZZNQKEBOW-UHFFFAOYSA-N |
| Molecular Weight | 442.154 g/mol |
| SMILES | C1(=NC=2C(N1CC=1C=C(C=CC1)Br)=CC=CC2)C=1C=C(C=CC1)Br |