| SpectraBase Spectrum ID |
8o4nxsS7ibt |
| Name |
xanthine, 3TMS |
| Comments |
Derivatization type: 3 TMS (mass: 368.152); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib001042; Note: The molecular formula of the structure shown is C5H4N4O2 - which differs from the formula reported for the mass spectrum (C14H28N4O2Si3) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H28N4O2Si3 |
| InChI |
InChI=1S/C14H28N4O2Si3/c1-21(2,3)18-10-15-11-12(18)16-14(20-23(7,8)9)17-13(11)19-22(4,5)6/h10H,1-9H3 |
| InChIKey |
XGJGXMUBMBXZQP-UHFFFAOYSA-N |
| Molecular Weight |
368.659 g/mol |
| SMILES |
c1nc2c([n]1[Si](C)(C)C)nc(nc2O[Si](C)(C)C)O[Si](C)(C)C |
| SPLASH |
splash10-0f6t-0922000000-cb4917c4d5d07da1137c |
| Source of Spectrum |
FM-2019-1042-0 |
| Synonyms |
Pseudoxanthine, 3TMS
Isoxanthine, 3TMS
Xanthin, 3TMS
Purine analog, 3TMS
Xanthic oxide, 3TMS
3,7-Dihydropurine-2,6-dione, 3TMS
9-(trimethylsilyl)-2,6-bis((trimethylsilyl)oxy)-9H-purine |
| Wiley ID |
1818701 |
![[2,6-bis(trimethylsilyloxy)purin-9-yl]-trimethylsilane](/api/spectrum/8o4nxsS7ibt/structure.png?h=300&w=458 "[2,6-bis(trimethylsilyloxy)purin-9-yl]-trimethylsilane")
