| SpectraBase Compound ID | ExaQyZEof7V |
|---|---|
| InChI | InChI=1S/C12H11BrN2/c13-9-6-7-12(11(14)8-9)15-10-4-2-1-3-5-10/h1-8,15H,14H2 |
| InChIKey | NBTKUAXTHMSWFA-UHFFFAOYSA-N |
| Mol Weight | 263.14 g/mol |
| Molecular Formula | C12H11BrN2 |
| Exact Mass | 262.010561 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 5H4bKz2z7kw |
|---|---|
| Name | 4-Bromo-N1-phenyl-o-phenylenediamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.010561362 u |
| Formula | C12H11BrN2 |
| InChI | InChI=1S/C12H11BrN2/c13-9-6-7-12(11(14)8-9)15-10-4-2-1-3-5-10/h1-8,15H,14H2 |
| InChIKey | NBTKUAXTHMSWFA-UHFFFAOYSA-N |
| SMILES | N(C=1C(=CC(=CC1)Br)N)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Raman) | 0.714741 |