SpectraBase Spectrum ID |
EOxd4aoIWEv |
Name |
Clozapine AC |
Classification |
Pharmaceutical drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
368.140389011 u |
Formula |
C20H21ClN4O |
InChI |
InChI=1S/C20H21ClN4O/c1-14(26)25-18-6-4-3-5-16(18)20(24-11-9-23(2)10-12-24)22-17-13-15(21)7-8-19(17)25/h3-8,13H,9-12H2,1-2H3 |
InChIKey |
RFOTYXUYVJKUSY-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
368.868 g/mol |
Nominal Mass |
368 u |
Quality |
912 |
Retention Index |
3009 |
SMILES |
C1=2N(C=3C(N=C(C2C=CC=C1)N1CCN(CC1)C)=CC(=CC3)Cl)C(=O)C |
SPLASH |
splash10-0089-9272000000-010893d949233363ad6e |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1-(8-chloro-11-(4-methylpiperazin-1-yl)-5H-dibenzo[b,e][1,4]diazepin-5-yl)ethan-1-one |
Technique |
GC/MS |
Wiley ID |
DD2024_000768 |