SpectraBase Spectrum ID |
KEMNR5xKGpY |
Name |
Olanzapine-M/artifact (N-oxide dimer) MS3_1 |
Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] |
Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
Formula |
C17H21N4OS |
InChI |
InChI=1S/C17H21N4OS/c1-12-11-15-16(23-12)17(20-7-9-21(2,22)10-8-20)19-14-6-4-3-5-13(14)18-15/h3-6,11,18,22H,7-10H2,1-2H3/q+1 |
InChIKey |
JZPSOHCQCNEIEF-UHFFFAOYSA-N |
Ion Polarity |
P |
Ionization Type |
ESI |
SMILES |
N1C2=C(N=C(N3CC[N+](CC3)(C)O)C3=C1C=C(S3)C)C=CC=C2 |
Sample Comments |
The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database. |
Sample Description |
Analyte Type: Metabolite |
Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
Spectrum Type |
ms3 |
Technique |
ITMS |