SpectraBase Spectrum ID |
GgiDmGPcBn |
Name |
Quetiapine |
Copyright |
Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved. |
Formula |
C21H25N3O2S |
InChI |
InChI=1S/C21H25N3O2S/c25-14-16-26-15-13-23-9-11-24(12-10-23)21-17-5-1-3-7-19(17)27-20-8-4-2-6-18(20)22-21/h1-8,25H,9-16H2 |
InChIKey |
URKOMYMAXPYINW-UHFFFAOYSA-N |
SMILES |
OCCOCCN1CCN(C=2c3c(Sc4c(cccc4)N2)cccc3)CC1 |
SPLASH |
splash10-08fv-4690000000-ed5f8fe6c0e17909378f |
Source of Spectrum |
Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences |