| SpectraBase Spectrum ID |
As9SeDC4E9h |
| Name |
4H-Pyrimido[1,6-A]pyrimidin-4-one, 2-(acetyloxy)-3-ethyl-9-phenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
309.111341352 u |
| Formula |
C17H15N3O3 |
| InChI |
InChI=1S/C17H15N3O3/c1-3-13-16(22)19-15-14(12-7-5-4-6-8-12)9-18-10-20(15)17(13)23-11(2)21/h4-10H,3H2,1-2H3 |
| InChIKey |
FHYLKPIXEWXFKM-UHFFFAOYSA-N |
| Molecular Weight |
309.325 g/mol |
| SMILES |
C1=2N(C(=C(C(N2)=O)CC)OC(=O)C)C=NC=C1C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940249 |
![4H-Pyrimido[1,6-a]pyrimidin-4-one, 2-(acetyloxy)-3-ethyl-9-phenyl-](/api/spectrum/As9SeDC4E9h/structure.png?h=300&w=458 "4H-Pyrimido[1,6-a]pyrimidin-4-one, 2-(acetyloxy)-3-ethyl-9-phenyl-")
