| SpectraBase Spectrum ID |
Kz8g8WgCz6L |
| Name |
2-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-purin-7-yl)-N-(4-trifluoromethoxy-phenyl)-acetamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
397.099788436 u |
| Formula |
C16H14F3N5O4 |
| InChI |
InChI=1S/C16H14F3N5O4/c1-22-13-12(14(26)23(2)15(22)27)24(8-20-13)7-11(25)21-9-3-5-10(6-4-9)28-16(17,18)19/h3-6,8H,7H2,1-2H3,(H,21,25) |
| InChIKey |
SKIZTOABRXIPIX-UHFFFAOYSA-N |
| Molecular Weight |
397.314 g/mol |
| SMILES |
C12=C(C(=O)N(C(N2C)=O)C)N(CC(NC=2C=CC(=CC2)OC(F)(F)F)=O)C=N1 |
