| SpectraBase Spectrum ID |
Dmxx08Mtu88 |
| Name |
Avanafil-A (-2H) 2TMS |
| Classification |
Pharmaceutical drug artifact derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
625.241968943 u |
| Formula |
C29H40ClN7O3Si2 |
| InChI |
InChI=1S/C29H40ClN7O3Si2/c1-39-25-12-11-21(16-24(25)30)19-37(41(2,3)4)27-23(28(38)33-18-26-31-13-9-14-32-26)17-34-29(35-27)36-15-8-10-22(36)20-40-42(5,6)7/h9,11-14,16-18,22H,8,10,15,19-20H2,1-7H3/b33-18- |
| InChIKey |
SONIXQHWGYGFMA-OHUYPAJKSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
626.308 g/mol |
| Nominal Mass |
625 u |
| Quality |
909 |
| Retention Index |
4930 |
| SMILES |
C=1(N([Si](C)(C)C)CC=2C=C(C(=CC2)OC)Cl)C(C(\N=C/C=2N=CC=CN2)=O)=CN=C(N2C(CCC2)CO[Si](C)(C)C)N1 |
| SPLASH |
splash10-05fs-1511190000-9b0e2259988da9f80952 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-((3-chloro-4-methoxybenzyl)(trimethylsilyl)amino)-N-((Z)-pyrimidin-2-ylmethylidene)-2-(2-\r(((trimethylsilyl)oxy)methyl)pyrrolidin-1-yl)pyrimidine-5-carboxamide |
| Technique |
On column GC/MS |
| Wiley ID |
DD2024_034471 |
