| SpectraBase Compound ID | HpM49mIxK18 |
|---|---|
| InChI | InChI=1S/C10H11BrN2O4/c1-3-17-10-5-8(12-6(2)14)9(13(15)16)4-7(10)11/h4-5H,3H2,1-2H3,(H,12,14) |
| InChIKey | CMKIPZUZPVCYCS-UHFFFAOYSA-N |
| Mol Weight | 303.11 g/mol |
| Molecular Formula | C10H11BrN2O4 |
| Exact Mass | 301.99022 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 | 13MzUJGW2X7 |
|---|---|
| Name | 4-Bromo-5-ethoxy-2-nitroaniline, N-acetyl |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.990219838 u |
| Formula | C10H11BrN2O4 |
| InChI | InChI=1S/C10H11BrN2O4/c1-3-17-10-5-8(12-6(2)14)9(13(15)16)4-7(10)11/h4-5H,3H2,1-2H3,(H,12,14) |
| InChIKey | CMKIPZUZPVCYCS-UHFFFAOYSA-N |
| SMILES | C1(OCC)=CC(=C(N(=O)=O)C=C1Br)NC(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.941456 |