![4-bromo-2-chloro-N-[(3-pyridyl)methylene]aniline](/api/spectrum/2RJOSiJEdFp/structure.png?h=300&w=458 "4-bromo-2-chloro-N-[(3-pyridyl)methylene]aniline")
| SpectraBase Compound ID | BaHz3MsRvJ6 |
|---|---|
| InChI | InChI=1S/C12H8BrClN2/c13-10-3-4-12(11(14)6-10)16-8-9-2-1-5-15-7-9/h1-8H/b16-8+ |
| InChIKey | LOSWOSGPHTUFAO-LZYBPNLTSA-N |
| Mol Weight | 295.57 g/mol |
| Molecular Formula | C12H8BrClN2 |
| Exact Mass | 293.955939 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2RJOSiJEdFp |
|---|---|
| Name | 4-Bromo-2-chloro-N-[(3-pyridyl)methylene]aniline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 293.955938966 u |
| Formula | C12H8BrClN2 |
| InChI | InChI=1S/C12H8BrClN2/c13-10-3-4-12(11(14)6-10)16-8-9-2-1-5-15-7-9/h1-8H/b16-8+ |
| InChIKey | LOSWOSGPHTUFAO-LZYBPNLTSA-N |
| Molecular Weight | 295.567 g/mol |
| SMILES | C=1C(=C(C=C(C1)Br)Cl)\N=C\C=1C=CC=NC1 |