| SpectraBase Spectrum ID |
EvWqoCgJX6E |
| Name |
Doxepin-M/artifact (N-oxide) +256 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 |
C19H21NO2 |
| InChI |
InChI=1S/C19H21NO2/c1-20(2,21)13-7-11-17-16-9-4-3-8-15(16)14-22-19-12-6-5-10-18(17)19/h3-6,8-12H,7,13-14H2,1-2H3/b17-11- |
| InChIKey |
QJCSDPQQGVJGQY-BOPFTXTBSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
CN(CC\C=C\1C=2C=CC=CC2COC2=C1C=CC=C2)(C)=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 |
