SpectraBase Spectrum ID |
Dlzu7HVMwW9 |
Name |
Pipazetate-M (N-oxide) MS2 |
Comments |
F: ITMS + c ESI d w Full ms2 416.10 |
Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
Formula |
C21H26N3O4S |
InChI |
InChI=1S/C21H26N3O4S/c25-21(28-16-15-27-14-13-24(26)11-4-1-5-12-24)23-17-7-2-3-8-18(17)29-19-9-6-10-22-20(19)23/h2-3,6-10,26H,1,4-5,11-16H2/q+1 |
InChIKey |
FDBSAHISPJZTFN-UHFFFAOYSA-N |
Ion Polarity |
P |
Ionization Type |
ESI |
SMILES |
O[N+]1(CCOCCOC(N2C=3N=CC=CC3SC=3C2=CC=CC3)=O)CCCCC1 |
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 |