| SpectraBase Spectrum ID |
2oYuGorm0Qa |
| Name |
Avanafil-A (-C5H6N2O) TMS |
| Classification |
Pharmaceutical drug artifact derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
445.170079395 u |
| Formula |
C21H28ClN5O2Si |
| InChI |
InChI=1S/C21H28ClN5O2Si/c1-28-19-8-7-15(10-18(19)22)12-24-20-16(11-23)13-25-21(26-20)27-9-5-6-17(27)14-29-30(2,3)4/h7-8,10,13,17H,5-6,9,12,14H2,1-4H3,(H,24,25,26) |
| InChIKey |
ZLWUICMLEKWQIT-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
446.026 g/mol |
| Nominal Mass |
445 u |
| Quality |
958 |
| Retention Index |
3482 |
| SMILES |
C=1(N2C(CCC2)CO[Si](C)(C)C)N=C(C(=CN1)C#N)NCC=1C=C(C(=CC1)OC)Cl |
| SPLASH |
splash10-0006-2509000000-9d9266e02b797deba183 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-((3-chloro-4-methoxybenzyl)amino)-2-(2-(((trimethylsilyl)oxy)methyl)pyrrolidin-1-yl)pyrimidine-5-\rcarbonitrile |
| Technique |
On column GC/MS |
| Wiley ID |
DD2024_034470 |
