| SpectraBase Spectrum ID |
LF3kLX4AGnG |
| Name |
Proxyphillin-tosylate |
| Alternate Name(s) |
7-(2'-Tosyloxypropyl)-theophilline |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H20N4O5S |
| InChI |
InChI=1S/C17H20N4O5S/c1-11-5-7-13(8-6-11)27(24,25)26-12(2)9-21-10-18-15-14(21)16(22)20(4)17(23)19(15)3/h5-8,10,12H,9H2,1-4H3 |
| InChIKey |
GQZBZBIUEGVQIJ-UHFFFAOYSA-N |
| Molecular Weight |
392.430 g/mol |
| SMILES |
c12c(C(=O)N(C(N2C)=O)C)[n](CC(OS(c2ccc(cc2)C)(=O)=O)C)cn1 |
| SPLASH |
splash10-0006-5967000000-0b8ed9ab8a71451df467 |
| Source of Spectrum |
D8-324-545-7 |
| Wiley ID |
1514162 |
