| SpectraBase Spectrum ID |
1b1npz4iVDQ |
| Name |
8-Chlorotheophylline |
| Source of Sample |
Aldrich |
| Catalog Number |
C71807 |
| CAS Registry Number |
85-18-7 |
| Classification |
5-membered fused aromatic heterocycles |
| Copyright |
Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H7ClN4O2 |
| InChI |
InChI=1S/C7H7ClN4O2/c1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14/h1-2H3,(H,9,10) |
| InChIKey |
RYIGNEOBDRVTHA-UHFFFAOYSA-N |
| Purity |
98% |
| Solvent |
Nujol |
| Source of Spectrum |
Sigma-Aldrich Co. LLC. |
| Synonyms |
8-Chloro-1,3-dimethyl-2,6(1H,3H)-purinedione |
| Technique |
Mull |
| Wiley ID |
SIAL_FTIR_1_9262 |
