| SpectraBase Spectrum ID |
9waVvxZhRL4 |
| Name |
Doxepin-M (HO-glucuronide) MS3_2 |
| 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/C17H14O2/c1-2-5-15-14-7-4-3-6-12(14)11-19-17-10-13(18)8-9-16(15)17/h3-10H,1-2,11H2/p+1/b15-5- |
| InChIKey |
REQMZVZTDGUUDC-WCSRMQSCSA-O |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OC1=CC2=C(\C(=C/C[CH2+])C=3C=CC=CC3CO2)C=C1 |
| 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 |
