| SpectraBase Spectrum ID |
KEnA1RlKNa0 |
| Name |
2-Amino-6-methyl-4-oxo-4H-1-benzopyran-3-carboxaldehyde |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
203.058243151 u |
| Formula |
C11H9NO3 |
| InChI |
InChI=1S/C11H9NO3/c1-6-2-3-9-7(4-6)10(14)8(5-13)11(12)15-9/h2-5H,12H2,1H3 |
| InChIKey |
ZUOLPKRXZRWAFV-UHFFFAOYSA-N |
| Molecular Weight |
203.197 g/mol |
| SMILES |
CC=1C=CC=2OC(=C(C(C2C1)=O)C=O)N |
| Spectrum/Structure Validation Score (Raman) |
0.852687 |
