| SpectraBase Compound ID | FClVAkcaPTf |
|---|---|
| InChI | InChI=1S/C26H34ClN7O3Si/c1-36-22-9-8-18(13-21(22)27)14-30-24-20(25(35)31-16-23-28-10-6-11-29-23)15-32-26(33-24)34-12-5-7-19(34)17-37-38(2,3)4/h6,8-11,13,15,19H,5,7,12,14,16-17H2,1-4H3,(H,31,35)(H,30,32,33) |
| InChIKey | VXSBBXQUEFHBFG-UHFFFAOYSA-N |
| Mol Weight | 556.1 g/mol |
| Molecular Formula | C26H34ClN7O3Si |
| Exact Mass | 555.218092 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Dk899nNMUTY |
|---|---|
| Name | Avanafil TMS |
| Classification | Pharmaceutical drug derivative |
| Copyright | Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass | 555.218092215 u |
| Formula | C26H34ClN7O3Si |
| InChI | InChI=1S/C26H34ClN7O3Si/c1-36-22-9-8-18(13-21(22)27)14-30-24-20(25(35)31-16-23-28-10-6-11-29-23)15-32-26(33-24)34-12-5-7-19(34)17-37-38(2,3)4/h6,8-11,13,15,19H,5,7,12,14,16-17H2,1-4H3,(H,31,35)(H,30,32,33) |
| InChIKey | VXSBBXQUEFHBFG-UHFFFAOYSA-N |
| Ionization Type | Electron Ionization (EI) |
| Molecular Weight | 556.142 g/mol |
| Nominal Mass | 555 u |
| Quality | 979 |
| Retention Index | 4493 |
| SMILES | C=1(C(C(NCC2=NC=CC=N2)=O)=CN=C(N2C(CO[Si](C)(C)C)CCC2)N1)NCC=1C=C(C(=CC1)OC)Cl |
| SPLASH | splash10-0udi-1412900000-dbb562e292bf0e61b17e |
| Source of Spectrum | DigiLab GmbH (C) 2024 |
| Synonyms | Spedra TMS Stendra TMS 4-((3-chloro-4-methoxybenzyl)amino)-N-(pyrimidin-2-ylmethyl)-2-(2-(((trimethylsilyl)oxy)methyl)\rpyrrolidin-1-yl)pyrimidine-5-carboxamide |
| Technique | GC/MS |
| Wiley ID | DD2024_029526 |