| SpectraBase Spectrum ID |
Aenn4iStVUd |
| Name |
7-[2-(1-adamantyl)-2-keto-ethyl]-8-bromo-1,3-dimethyl-xanthine |
| Alternate Name(s) |
7-[2-(1-adamantyl)-2-oxidanylidene-ethyl]-8-bromanyl-1,3-dimethyl-purine-2,6-dione
7-[2-(1-adamantyl)-2-oxo-ethyl]-8-bromo-1,3-dimethyl-purine-2,6-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H23BrN4O3 |
| InChI |
InChI=1S/C19H23BrN4O3/c1-22-15-14(16(26)23(2)18(22)27)24(17(20)21-15)9-13(25)19-6-10-3-11(7-19)5-12(4-10)8-19/h10-12H,3-9H2,1-2H3/t10-,11+,12-,19- |
| InChIKey |
RCTGQNOBUGGHNN-RDLDAJNDSA-N |
| Molecular Weight |
435.322 g/mol |
| SMILES |
c12c([n](CC(C34C[C@]5(C[C@@](C4)(C[C@@](C3)(C5)[H])[H])[H])=O)c(n2)Br)C(=O)N(C(N1C)=O)C |
| SPLASH |
splash10-000i-4900000000-94ec4d3e15cfd995f26c |
| Wiley ID |
1454625 |
![7-[2-(1-adamantyl)-2-oxoethyl]-8-bromo-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione](/api/spectrum/Aenn4iStVUd/structure.png?h=300&w=458 "7-[2-(1-adamantyl)-2-oxoethyl]-8-bromo-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione")
