For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Quetiapine-M (N-CH2-COOH-HO-) MS3_1

View entire compound with spectra: 3 MS (LC)

Quetiapine-M (N-CH2-COOH-HO-) MS3_1
SpectraBase Compound ID IRv8AAULHTU
InChI InChI=1S/4C17H14N2OS/c1-3-19(4-2)17-12-8-5-6-11-15(12)21-16-13(18-17)9-7-10-14(16)20;1-3-19(4-2)17-12-8-5-6-10-14(12)21-15-11-7-9-13(20)16(15)18-17;1-3-19(4-2)17-13-7-5-6-8-15(13)21-16-10-9-12(20)11-14(16)18-17;1-3-19(4-2)17-13-7-5-6-8-15(13)21-16-11-12(20)9-10-14(16)18-17/h4*3,5-11H,1-2,4H2/p+4
InChIKey UUMHSKPRIDZSFX-UHFFFAOYSA-R
Mol Weight 295.38 g/mol
Molecular Formula C17H15N2OS
Exact Mass 295.090509 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IwK8nigeAIr
Name Quetiapine-M (N-CH2-COOH-HO-) MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [70.00-310.00]
Copyright Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved.
Ion Polarity P
Ionization Type ESI
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