| SpectraBase Spectrum ID |
JWn1lhXeLLI |
| Name |
2,4(3H,8H)-Pteridinedione, 8-ethyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
192.064725512 u |
| Formula |
C8H8N4O2 |
| InChI |
InChI=1S/C8H8N4O2/c1-2-12-4-3-9-5-6(12)10-8(14)11-7(5)13/h3-4H,2H2,1H3,(H,11,13,14) |
| InChIKey |
YDMRACFNQPJDNK-UHFFFAOYSA-N |
| Molecular Weight |
192.178 g/mol |
| SMILES |
C(C)N1C=2C(C(=O)NC(N2)=O)=NC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95838 |
