| SpectraBase Spectrum ID |
G6bvprMB8F4 |
| Name |
(E)-1,7-dimethyl-3-(4-hydroxy-3-methylbut-2-enyl)-xanthine |
| Alternate Name(s) |
3-[(2E)-4-hydroxy-3-methyl-2-butenyl]-1,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H16N4O3 |
| InChI |
InChI=1S/C12H16N4O3/c1-8(6-17)4-5-16-10-9(14(2)7-13-10)11(18)15(3)12(16)19/h4,7,17H,5-6H2,1-3H3/b8-4+ |
| InChIKey |
JTGZKILLRYATOF-XBXARRHUSA-N |
| Molecular Weight |
264.285 g/mol |
| SMILES |
OC\C(=C\CN1c2c(C(N(C)C1=O)=O)[n](C)cn2)C |
| SPLASH |
splash10-001i-0920000000-eabb223ca975434c5ae1 |
| Source of Spectrum |
LQ-1992-3153-0 |
| Wiley ID |
1267578 |
