| SpectraBase Spectrum ID |
HODop0U1mnp |
| Name |
2-Hydroxy-3-phenyl-4H-pyrazino-(1,2-A)pyrimidine-4-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
239.069476540 u |
| Formula |
C13H9N3O2 |
| InChI |
InChI=1S/C13H9N3O2/c17-12-11(9-4-2-1-3-5-9)13(18)16-7-6-14-8-10(16)15-12/h1-8,17H |
| InChIKey |
BHBLOBRJLDMUNP-UHFFFAOYSA-N |
| Molecular Weight |
239.234 g/mol |
| SMILES |
C1(C(=C(O)N=C2N1C=CN=C2)C1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.941953 |
