SpectraBase Spectrum ID |
588rPaZRG6u |
Name |
Alizapride-M (O-demethyl-) MS2 |
Comments |
F: ITMS + c ESI d w Full ms2 302.10 |
Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
Formula |
C15H19N5O2 |
InChI |
InChI=1S/C15H19N5O2/c1-2-5-20-6-3-4-10(20)9-16-15(22)11-7-12-13(8-14(11)21)18-19-17-12/h2,7-8,10,21H,1,3-6,9H2,(H,16,22)(H,17,18,19) |
InChIKey |
BSLSUCCQZXRXBT-UHFFFAOYSA-N |
Ion Polarity |
P |
Ionization Type |
ESI |
SMILES |
OC1=C(C(=O)NCC2CCCN2CC=C)C=C2C(=C1)N=NN2 |
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 |
ms2 |
Technique |
ITMS |