| SpectraBase Spectrum ID |
KbavEdKOOzh |
| Name |
5,8-Dihydro-8-oxo-1,3-dioxolo[4,5-G]quinoline-6,7-dicarboxylic acid, dimethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
305.053551691 u |
| Formula |
C14H11NO7 |
| InChI |
InChI=1S/C14H11NO7/c1-19-13(17)10-11(14(18)20-2)15-7-4-9-8(21-5-22-9)3-6(7)12(10)16/h3-4H,5H2,1-2H3,(H,15,16) |
| InChIKey |
DRWXAOSUPZHIDQ-UHFFFAOYSA-N |
| SMILES |
N1C=2C=C3OCOC3=CC2C(C(=C1C(OC)=O)C(OC)=O)=O |
| Spectrum/Structure Validation Score (Raman) |
0.965232 |
![5,8-Dihydro-8-oxo-1,3-dioxolo[4,5-G]quinoline-6,7-dicarboxylic acid, dimethyl ester](/api/spectrum/KbavEdKOOzh/structure.png?h=300&w=458 "5,8-Dihydro-8-oxo-1,3-dioxolo[4,5-G]quinoline-6,7-dicarboxylic acid, dimethyl ester")
