| SpectraBase Spectrum ID |
AawKAC9VVCL |
| Name |
4H-1-Benzopyran-6-carboxaldehyde, 7-hydroxy-5,8-dimethoxy-2-methyl-4-oxo- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
264.063388100 u |
| Formula |
C13H12O6 |
| InChI |
InChI=1S/C13H12O6/c1-6-4-8(15)9-11(17-2)7(5-14)10(16)13(18-3)12(9)19-6/h4-5,16H,1-3H3 |
| InChIKey |
SKWOTTHAIZPPTG-UHFFFAOYSA-N |
| Molecular Weight |
264.233 g/mol |
| SMILES |
OC1=C(C2=C(C(=C1C=O)OC)C(C=C(O2)C)=O)OC |
| Spectrum/Structure Validation Score (Raman) |
0.844845 |
