| SpectraBase Spectrum ID |
JH4sKuQWVrE |
| Name |
Clozapine-M (7 OH) AC |
| Classification |
Pharmaceutical drug metabolite |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
384.135303630 u |
| Formula |
C20H21ClN4O2 |
| InChI |
InChI=1S/C20H21ClN4O2/c1-13(26)27-19-12-18-17(11-15(19)21)23-20(25-9-7-24(2)8-10-25)14-5-3-4-6-16(14)22-18/h3-6,11-12,22H,7-10H2,1-2H3 |
| InChIKey |
CDGXAKZVRGQMNW-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
384.867 g/mol |
| Nominal Mass |
384 u |
| Quality |
899 |
| Retention Index |
3156 |
| SMILES |
C=1(C2=C(NC=3C(N1)=CC(=C(C3)OC(=O)C)Cl)C=CC=C2)N1CCN(CC1)C |
| SPLASH |
splash10-11b9-1097000000-6a2fb36adf7ada72a14d |
| Sample Comments |
Acetyl position uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
8-chloro-11-(4-methylpiperazin-1-yl)-5H-dibenzo[b,e][1,4]diazepin-7-yl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000783 |
