| SpectraBase Spectrum ID |
55JD54CBY1M |
| Name |
Pentoxifylline |
| Alternate Name(s) |
3,7-Dihydro-3,7-dimethyl-1-(5-oxohexyl)-1H-purine-2,6-dione
3,7-Dimethyl-1-(5-oxohexyl)purine-2,6-dione
3,7-Dimethyl-1-(5-oxohexyl)-1H,3H-purin-2,6-dione
Dimethyloxohexylxanthine |
| CAS Registry Number |
6493-05-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H18N4O3 |
| InChI |
InChI=1S/C13H18N4O3/c1-9(18)6-4-5-7-17-12(19)10-11(14-8-15(10)2)16(3)13(17)20/h8H,4-7H2,1-3H3 |
| InChIKey |
BYPFEZZEUUWMEJ-UHFFFAOYSA-N |
| Molecular Weight |
278.312 g/mol |
| SMILES |
c12c(C(N(CCCCC(=O)C)C(N2C)=O)=O)[n](C)cn1 |
| SPLASH |
splash10-00al-2950000000-7c37c76591845fc20cbc |
| Source of Spectrum |
CJ-1992-0-0 |
| Wiley ID |
1281674 |
