| SpectraBase Spectrum ID |
5UouKBNyGR6 |
| Name |
Imidazosagatriazinonedichloroethene |
| Classification |
Pharmaceutical drug intermediate |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
406.096331298 u |
| Formula |
C19H20Cl2N4O2 |
| InChI |
InChI=1S/C19H20Cl2N4O2/c1-4-6-14-16-17(25(3)24-14)19(26)23-18(22-16)12-9-11(13(21)10-20)7-8-15(12)27-5-2/h7-10H,4-6H2,1-3H3,(H,22,23,26)/b13-10+ |
| InChIKey |
VMGSRGGXUFBMAP-JLHYYAGUSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
407.301 g/mol |
| Nominal Mass |
406 u |
| Quality |
987 |
| Retention Index |
3119 |
| SMILES |
C12=C(C(NC(C=3C(=CC=C(C3)\C(=C/Cl)Cl)OCC)=N1)=O)N(N=C2CCC)C |
| SPLASH |
splash10-0a4u-1519200000-f54fd118423741575444 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
5-(5-(1,2-dichloroethenyl)-2-ethoxyphenyl)-1-methyl-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]\rpyrimidin-7-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_017976 |
