| SpectraBase Spectrum ID |
DnXPdmVHZmi |
| Name |
Cafedrine 2TMS |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
501.259143203 u |
| Formula |
C24H39N5O3Si2 |
| InChI |
InChI=1S/C24H39N5O3Si2/c1-18(21(32-34(7,8)9)19-13-11-10-12-14-19)29(33(4,5)6)16-15-28-17-25-22-20(28)23(30)27(3)24(31)26(22)2/h10-14,17-18,21H,15-16H2,1-9H3 |
| InChIKey |
YMQQLDHINBHSFQ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
501.778 g/mol |
| Nominal Mass |
501 u |
| Quality |
1000 |
| Retention Index |
3923 |
| SMILES |
C12=C(N(C(N(C2=O)C)=O)C)N=CN1CCN(C(C(C=1C=CC=CC1)O[Si](C)(C)C)C)[Si](C)(C)C |
| SPLASH |
splash10-00di-3229000000-c01c974f6fe1737592e2 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1,3-dimethyl-7-(2-((1-Phenyl-1-((trimethylsilyl)oxy)propan-2-yl)(trimethylsilyl)amino)ethyl)-3,7-dihydro-1H-\rpurine-2,6-dione |
| Technique |
GC/MS |
| Wiley ID |
DD2024_024733 |
