| SpectraBase Spectrum ID |
JHZcjv20Wsi |
| Name |
Desmethylclozapine |
| CAS Registry Number |
6104-71-8 |
| Classification |
Pharmaceutical drug metabolite |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
312.114174263 u |
| Formula |
C17H17ClN4 |
| InChI |
InChI=1S/C17H17ClN4/c18-12-5-6-15-16(11-12)21-17(22-9-7-19-8-10-22)13-3-1-2-4-14(13)20-15/h1-6,11,19-20H,7-10H2 |
| InChIKey |
JNNOSTQEZICQQP-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
312.804 g/mol |
| Nominal Mass |
312 u |
| Quality |
924 |
| SMILES |
C=1(C2=C(NC=3C(N1)=CC(=CC3)Cl)C=CC=C2)N1CCNCC1 |
| SPLASH |
splash10-0006-7590000000-ac435ce477623123921a |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
8-chloro-11-(piperazin-1-yl)-5H-dibenzo[b,e][1,4]diazepine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_034549 |
