| SpectraBase Compound ID | 39gVKRGgV2x |
|---|---|
| InChI | InChI=1S/C8H9BrN2O3/c1-2-14-8-4-6(10)7(11(12)13)3-5(8)9/h3-4H,2,10H2,1H3 |
| InChIKey | VZUYPQXQCGVAFU-UHFFFAOYSA-N |
| Mol Weight | 261.07 g/mol |
| Molecular Formula | C8H9BrN2O3 |
| Exact Mass | 259.979655 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 | Igj26agDKEA |
|---|---|
| Name | 4-Bromo-5-ethoxy-2-nitroaniline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 259.979655155 u |
| Formula | C8H9BrN2O3 |
| InChI | InChI=1S/C8H9BrN2O3/c1-2-14-8-4-6(10)7(11(12)13)3-5(8)9/h3-4H,2,10H2,1H3 |
| InChIKey | VZUYPQXQCGVAFU-UHFFFAOYSA-N |
| SMILES | C1(N)=C(C=C(C(=C1)OCC)Br)N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.873906 |