| SpectraBase Spectrum ID |
DDtE4LTtJeR |
| Name |
8-Butyl-9-(2-hydroxyethyl)-1-methyl-3H-purine-2,6-dione |
| Alternate Name(s) |
8-Butyl-9-(2-hydroxyethyl)-1-methyl-xanthine |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H18N4O3 |
| InChI |
InChI=1S/C12H18N4O3/c1-3-4-5-8-13-9-10(16(8)6-7-17)14-12(19)15(2)11(9)18/h17H,3-7H2,1-2H3,(H,14,19) |
| InChIKey |
QQDKDDMDUHIALV-UHFFFAOYSA-N |
| Molecular Weight |
266.301 g/mol |
| SMILES |
N1C(N(C(c2c1[n](CCO)c(n2)CCCC)=O)C)=O |
| SPLASH |
splash10-00si-0980000000-aa6bd08bff7a4898a33b |
| Source of Spectrum |
G-63-414-4 |
| Wiley ID |
749410 |
