| SpectraBase Compound ID | 88fS0QLRBNw |
|---|---|
| InChI | InChI=1S/C9H9BrClNO2/c1-5(13)12-8-4-6(11)3-7(10)9(8)14-2/h3-4H,1-2H3,(H,12,13) |
| InChIKey | JSPAOQUPWNODCH-UHFFFAOYSA-N |
| Mol Weight | 278.53 g/mol |
| Molecular Formula | C9H9BrClNO2 |
| Exact Mass | 276.950519 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | JV72K5vnTpQ |
|---|---|
| Name | 3-Bromo-5-chloro-2-methoxyaniline, N-acetyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.950519232 u |
| Formula | C9H9BrClNO2 |
| InChI | InChI=1S/C9H9BrClNO2/c1-5(13)12-8-4-6(11)3-7(10)9(8)14-2/h3-4H,1-2H3,(H,12,13) |
| InChIKey | JSPAOQUPWNODCH-UHFFFAOYSA-N |
| SMILES | C1(Br)=C(C(=CC(=C1)Cl)NC(=O)C)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.941226 |