| SpectraBase Compound ID | LOwhSRwvLKv |
|---|---|
| InChI | InChI=1S/C12H10BrN/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14/h1-8H,14H2 |
| InChIKey | RNHROIARQQOJTL-UHFFFAOYSA-N |
| Mol Weight | 248.12 g/mol |
| Molecular Formula | C12H10BrN |
| Exact Mass | 246.999662 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FKFQJIrtMtO |
|---|---|
| Name | 2-(2-Bromophenyl)aniline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.999662326 u |
| Formula | C12H10BrN |
| InChI | InChI=1S/C12H10BrN/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14/h1-8H,14H2 |
| InChIKey | RNHROIARQQOJTL-UHFFFAOYSA-N |
| Molecular Weight | 248.123 g/mol |
| SMILES | C=1(N)C(=CC=CC1)C=1C(=CC=CC1)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.953257 |