| SpectraBase Spectrum ID |
3ZcFHzVkO0 |
| Name |
Propoxyhomohydroxysildenafil |
| CAS Registry Number |
139755-87-6 |
| Classification |
Pharmaceutical drug, vasodilator |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
518.231139388 u |
| Formula |
C24H34N6O5S |
| InChI |
InChI=1S/C24H34N6O5S/c1-4-6-19-21-22(28(3)27-19)24(32)26-23(25-21)18-16-17(7-8-20(18)35-15-5-2)36(33,34)30-11-9-29(10-12-30)13-14-31/h7-8,16,31H,4-6,9-15H2,1-3H3,(H,25,26,32) |
| InChIKey |
DDQVAJSWFPJSGC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
518.633 g/mol |
| Nominal Mass |
518 u |
| Quality |
992 |
| SMILES |
OCCN1CCN(S(C=2C=C(C=3NC4=C(C(N3)=O)N(N=C4CCC)C)C(=CC2)OCCC)(=O)=O)CC1 |
| SPLASH |
splash10-054k-9421200000-0fbcf2ad46b55e297bc6 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
PP-HHS
Propoxyphenyl Homohydroxysildenafil
5-(5-((4-(2-hydroxyethyl)piperazin-1-yl)sulfonyl)-2-propoxyphenyl)-1-methyl-3-propyl-1,4-dihydro-\r7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Technique |
DI/MS |
| Wiley ID |
DD2024_022798 |
