| SpectraBase Spectrum ID |
8tNuYWvzJlU |
| Name |
4-Isoquinolinol, 1,2,3,4-tetrahydro-6,7-dimethoxy-2-nitroso |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
238.095356935 u |
| Formula |
C11H14N2O4 |
| InChI |
InChI=1S/C11H14N2O4/c1-16-10-3-7-5-13(12-15)6-9(14)8(7)4-11(10)17-2/h3-4,9,14H,5-6H2,1-2H3 |
| InChIKey |
KSBWDXKRSNBVLR-UHFFFAOYSA-N |
| Molecular Weight |
238.243 g/mol |
| SMILES |
C1(OC)=CC=2CN(N=O)CC(C2C=C1OC)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.952721 |
