| SpectraBase Spectrum ID |
KVrx88frYd |
| Name |
1,3,7-trimethyl-8-(2,2,2-trifluoroethoxy)purine-2,6-dione |
| Alternate Name(s) |
1,3,7-trimethyl-8-(2,2,2-trifluoroethoxy)xanthine
1,3,7-trimethyl-8-[2,2,2-tris(fluoranyl)ethoxy]purine-2,6-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H11F3N4O3 |
| InChI |
InChI=1S/C10H11F3N4O3/c1-15-5-6(14-8(15)20-4-10(11,12)13)16(2)9(19)17(3)7(5)18/h4H2,1-3H3 |
| InChIKey |
FMDKXUGRTYYNCB-UHFFFAOYSA-N |
| Molecular Weight |
292.218 g/mol |
| SMILES |
c12c(C(=O)N(C(N2C)=O)C)[n](C)c(n1)OCC(F)(F)F |
| SPLASH |
splash10-0536-3090000000-65d13373f49592a4fa5f |
| Source of Spectrum |
U1-1999-2425-6 |
| Wiley ID |
753714 |
