| SpectraBase Spectrum ID |
6L78h3cndFI |
| Name |
Doxepin-M (bis-nor-HO-glucuronide) 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. |
| InChI |
InChI=1S/C17H17NO2/c18-9-3-6-15-14-5-2-1-4-12(14)11-20-17-10-13(19)7-8-16(15)17/h1-2,4-8,10,19H,3,9,11,18H2/b15-6- |
| InChIKey |
HRAHDBAWCSQZEF-UUASQNMZSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
NCC\C=C/1C=2C=CC(=CC2OCC=2C=CC=CC12)O |
| 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 |
