SpectraBase Spectrum ID |
9WYTllMbJL7 |
Name |
Clomipramine-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 |
C19H24ClN2O |
InChI |
InChI=1S/C19H24ClN2O/c1-22(2,23)13-5-12-21-18-7-4-3-6-15(18)8-9-16-10-11-17(20)14-19(16)21/h3-4,6-7,10-11,14,23H,5,8-9,12-13H2,1-2H3/q+1 |
InChIKey |
AQTLHTBDWGCDJQ-UHFFFAOYSA-N |
Ion Polarity |
P |
Ionization Type |
ESI |
SMILES |
O[N+](CCCN1C=2C=CC=CC2CCC2=CC=C(C=C12)Cl)(C)C |
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 |