| SpectraBase Spectrum ID |
ECe79M70b9j |
| Name |
3-[1,3-Dimethyl-8-(4-morpholinyl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]propanenitrile |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
318.144038461 u |
| Formula |
C14H18N6O3 |
| InChI |
InChI=1S/C14H18N6O3/c1-17-11-10(12(21)18(2)14(17)22)20(5-3-4-15)13(16-11)19-6-8-23-9-7-19/h3,5-9H2,1-2H3 |
| InChIKey |
MQTXDDWOXDUGJU-UHFFFAOYSA-N |
| Molecular Weight |
318.337 g/mol |
| SMILES |
C12=C(C(=O)N(C(N2C)=O)C)N(CCC#N)C(=N1)N1CCOCC1 |
![3-[1,3-dimethyl-8-(4-morpholinyl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]propanenitrile](/api/spectrum/ECe79M70b9j/structure.png?h=300&w=458 "3-[1,3-dimethyl-8-(4-morpholinyl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]propanenitrile")
