| SpectraBase Compound ID | 87ySnGJkSnF |
|---|---|
| InChI | InChI=1S/C20H17BrN2O/c1-14(23-20(24)18-11-19(21)13-22-12-18)15-7-9-17(10-8-15)16-5-3-2-4-6-16/h2-14H,1H3,(H,23,24) |
| InChIKey | FFJYJYSZDVKMTN-UHFFFAOYSA-N |
| Mol Weight | 381.27 g/mol |
| Molecular Formula | C20H17BrN2O |
| Exact Mass | 380.052426 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JyOBDTmU7nw |
|---|---|
| Name | N-(1-Biphenyl-4-yl-ethyl)-5-bromo-nicotinamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 380.052426174 u |
| Formula | C20H17BrN2O |
| InChI | InChI=1S/C20H17BrN2O/c1-14(23-20(24)18-11-19(21)13-22-12-18)15-7-9-17(10-8-15)16-5-3-2-4-6-16/h2-14H,1H3,(H,23,24) |
| InChIKey | FFJYJYSZDVKMTN-UHFFFAOYSA-N |
| Molecular Weight | 381.273 g/mol |
| SMILES | C(C1=CC(Br)=CN=C1)(NC(C1=CC=C(C2=CC=CC=C2)C=C1)C)=O |