| SpectraBase Spectrum ID |
GBNtXF8BnI4 |
| Name |
1H-Purine-2,6-dione, 3,7-dihydro-1,7-dimethyl- |
| Alternate Name(s) |
1,7-Dimethyl-3,7-dihydro-1H-purine-2,6-dione
1,7-Dimethyl-3H-purine-2,6-dione
1,7-Dimethylxanthine
3,7-Dihydro-1,7-dimethyl-1H-purine-2,6-dione
p-Xanthine
Paraxanthine
Xanthine, 1,7-dimethyl-
BRN 0197907
EINECS 210-271-9
NSC 400018 |
| CAS Registry Number |
611-59-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H8N4O2 |
| InChI |
InChI=1S/C7H8N4O2/c1-10-3-8-5-4(10)6(12)11(2)7(13)9-5/h3H,1-2H3,(H,9,13) |
| InChIKey |
QUNWUDVFRNGTCO-UHFFFAOYSA-N |
| Molecular Weight |
180.167 g/mol |
| SMILES |
N1C(N(C(c2c1nc[n]2C)=O)C)=O |
| SPLASH |
splash10-01c0-8900000000-e55c89f90d6b4d365c5c |
| Source of Spectrum |
BS-4-35-0 |
| Wiley ID |
1175753 |
