| SpectraBase Spectrum ID |
HWSpzbjnkHA |
| Name |
1-(4,5-Dimethoxy-2-nitrophenyl)ethanol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
227.079372518 u |
| Formula |
C10H13NO5 |
| InChI |
InChI=1S/C10H13NO5/c1-6(12)7-4-9(15-2)10(16-3)5-8(7)11(13)14/h4-6,12H,1-3H3 |
| InChIKey |
KMRZADDYRLREOY-UHFFFAOYSA-N |
| Molecular Weight |
227.216 g/mol |
| SMILES |
C(C)(O)C1=C(C=C(C(=C1)OC)OC)N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.861298 |
