| SpectraBase Compound ID | CTDo3VhfEO6 |
|---|---|
| InChI | InChI=1S/C8H11NO2/c1-10-7-4-3-6(9)5-8(7)11-2/h3-5H,9H2,1-2H3 |
| InChIKey | LGDHZCLREKIGKJ-UHFFFAOYSA-N |
| Mol Weight | 153.18 g/mol |
| Molecular Formula | C8H11NO2 |
| Exact Mass | 153.078979 g/mol |
| SpectraBase Spectrum ID | 5XRG5xHIeXR |
|---|---|
| Name | 3,4-Dimethoxyaniline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 153.078978596 u |
| Formula | C8H11NO2 |
| InChI | InChI=1S/C8H11NO2/c1-10-7-4-3-6(9)5-8(7)11-2/h3-5H,9H2,1-2H3 |
| InChIKey | LGDHZCLREKIGKJ-UHFFFAOYSA-N |
| SMILES | NC=1C=CC(=C(C1)OC)OC |
| Spectrum/Structure Validation Score (Raman) | 0.975587 |