| SpectraBase Spectrum ID |
23PASYS0JhK |
| Name |
Sertraline-M (nor-glucuronide) MS3_1 |
| Comments |
T: ITMS + c ESI d w Full ms3 [email protected] [email protected] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C16H13Cl2/c17-15-10-4-9-14(16(15)18)13-8-3-6-11-5-1-2-7-12(11)13/h1-2,4-7,9-10,13H,3,8H2/q+1 |
| InChIKey |
OLIDXLDLRBAIIG-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
[CH+]1CCC(C=2C1=CC=CC2)C=1C(=C(Cl)C=CC1)Cl |
| 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 |
