| SpectraBase Compound ID | I18LKJk61so |
|---|---|
| InChI | InChI=1S/C6H7NO2/c7-5-2-1-4(8)3-6(5)9/h1-3,8-9H,7H2 |
| InChIKey | ROCVGJLXIARCAC-UHFFFAOYSA-N |
| Mol Weight | 125.13 g/mol |
| Molecular Formula | C6H7NO2 |
| Exact Mass | 125.047678 g/mol |
| SpectraBase Spectrum ID | Mn6TOgTiBD |
|---|---|
| Name | 4-Aminoresorcinol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 125.047678467 u |
| Formula | C6H7NO2 |
| InChI | InChI=1S/C6H7NO2/c7-5-2-1-4(8)3-6(5)9/h1-3,8-9H,7H2 |
| InChIKey | ROCVGJLXIARCAC-UHFFFAOYSA-N |
| Molecular Weight | 125.127 g/mol |
| SMILES | C1(N)=C(O)C=C(O)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.962047 |