| SpectraBase Spectrum ID |
FrY6EAamWqD |
| Name |
4H-[1]Benzopyrano[2,3-D]pyrimidine-2-carboxylic acid, 3,5-dihydro-4,5-dioxo-, ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
286.058971425 u |
| Formula |
C14H10N2O5 |
| InChI |
InChI=1S/C14H10N2O5/c1-2-20-14(19)11-15-12(18)9-10(17)7-5-3-4-6-8(7)21-13(9)16-11/h3-6H,2H2,1H3,(H,15,16,18) |
| InChIKey |
HMWJZWCZWHTCCM-UHFFFAOYSA-N |
| Molecular Weight |
286.243 g/mol |
| SMILES |
C12=C(N=C(NC2=O)C(=O)OCC)OC=2C(C1=O)=CC=CC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.976529 |
![4H-[1]Benzopyrano[2,3-d]pyrimidine-2-carboxylic acid, 3,5-dihydro-4,5-dioxo-, ethyl ester](/api/spectrum/FrY6EAamWqD/structure.png?h=300&w=458 "4H-[1]Benzopyrano[2,3-d]pyrimidine-2-carboxylic acid, 3,5-dihydro-4,5-dioxo-, ethyl ester")
