| SpectraBase Spectrum ID |
AT9Ubb9tVYa |
| Name |
4H-Pyrido[1,2-A]pyrimidine-3-carboxylic acid, 6,8-dimethyl-4-oxo-, ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
246.100442316 u |
| Formula |
C13H14N2O3 |
| InChI |
InChI=1S/C13H14N2O3/c1-4-18-13(17)10-7-14-11-6-8(2)5-9(3)15(11)12(10)16/h5-7H,4H2,1-3H3 |
| InChIKey |
YJTMOGMHROYTOO-UHFFFAOYSA-N |
| Molecular Weight |
246.266 g/mol |
| SMILES |
C1(=O)N2C(=NC=C1C(OCC)=O)C=C(C=C2C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.935089 |
![4H-Pyrido[1,2-a]pyrimidine-3-carboxylic acid, 6,8-dimethyl-4-oxo-, ethyl ester](/api/spectrum/AT9Ubb9tVYa/structure.png?h=300&w=458 "4H-Pyrido[1,2-a]pyrimidine-3-carboxylic acid, 6,8-dimethyl-4-oxo-, ethyl ester")
