| SpectraBase Spectrum ID |
DnL5KZjOdDE |
| Name |
Desmethylcarbodenafil |
| CAS Registry Number |
147676-79-7 |
| Classification |
Sildenafil analog |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
438.237938847 u |
| Formula |
C23H30N6O3 |
| InChI |
InChI=1S/C23H30N6O3/c1-5-7-17-19-20(28(4)26-17)22(30)25-21(24-19)16-14-15(8-9-18(16)32-6-2)23(31)29-12-10-27(3)11-13-29/h8-9,14H,5-7,10-13H2,1-4H3,(H,24,25,30) |
| InChIKey |
RIFGMSHSTNMHMS-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
438.532 g/mol |
| Nominal Mass |
438 u |
| Quality |
993 |
| Retention Index |
3669 |
| SMILES |
C12=C(N=C(C=3C(=CC=C(C3)C(N3CCN(CC3)C)=O)OCC)NC2=O)C(=NN1C)CCC |
| SPLASH |
splash10-00e9-9213000000-c3b96a5661c97895fcf7 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Black 3K
5-[2-Ethoxy-5-(4-methylpiperazine-1-carbonyl)phenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-\r7-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_023501 |
