| SpectraBase Spectrum ID |
5VHtTbDbZqi |
| Name |
3-METHYLXANTHINE |
| Compound Number |
3 |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C6H6N4O2 |
| InChI |
InChI=1S/C6H6N4O2/c1-10-4-3(7-2-8-4)5(11)9-6(10)12/h2H,1H3,(H,7,8)(H,9,11,12) |
| InChIKey |
GMSNIKWWOQHZGF-UHFFFAOYSA-N |
| Literature Reference Author |
B.S.LINDSAY,A.M.P.ALMEIDA,C.J.SMITH,R.G.S.BERLINCK,R.M.DAROC
HA,C.M.IRELAND |
| Literature Reference Citation |
J.NAT.PROD.,62,1573(1999) |
| Literature Reference DOI |
10.1021/np990211l |
| Molecular Weight |
166.139 g/mol |
| Solvent |
CD3OD |
| Source File Reference |
WANG715 |
