| SpectraBase Spectrum ID |
G07yUqSkrmP |
| Name |
1(4H)-Quinazolineacetic acid, 2-ethyl-4-oxo-, methyl 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/c1-3-11-14-13(17)9-6-4-5-7-10(9)15(11)8-12(16)18-2/h4-7H,3,8H2,1-2H3 |
| InChIKey |
RZAAYMOVLJUPIK-UHFFFAOYSA-N |
| Molecular Weight |
246.266 g/mol |
| SMILES |
C1(N=C(N(C=2C=CC=CC12)CC(=O)OC)CC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.943168 |
