![N-(5-bromo-2-pyridinyl)[1,1'-biphenyl]-4-carboxamide](/api/spectrum/6lqqNVeNGuu/structure.png?h=300&w=458 "N-(5-bromo-2-pyridinyl)[1,1'-biphenyl]-4-carboxamide")
| SpectraBase Compound ID | 8jiyo27uzUH |
|---|---|
| InChI | InChI=1S/C18H13BrN2O/c19-16-10-11-17(20-12-16)21-18(22)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-12H,(H,20,21,22) |
| InChIKey | QDXIXYCEOBQITN-UHFFFAOYSA-N |
| Mol Weight | 353.22 g/mol |
| Molecular Formula | C18H13BrN2O |
| Exact Mass | 352.021126 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6lqqNVeNGuu |
|---|---|
| Name | N-(5-Bromo-2-pyridinyl)[1,1'-biphenyl]-4-carboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 352.021126046 u |
| Formula | C18H13BrN2O |
| InChI | InChI=1S/C18H13BrN2O/c19-16-10-11-17(20-12-16)21-18(22)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-12H,(H,20,21,22) |
| InChIKey | QDXIXYCEOBQITN-UHFFFAOYSA-N |
| Molecular Weight | 353.219 g/mol |
| SMILES | N(C(C1=CC=C(C=2C=CC=CC2)C=C1)=O)C1=NC=C(C=C1)Br |