| SpectraBase Spectrum ID |
8UroP1yQy0 |
| Name |
Amitriptyline-M (bis-nor-di-HO-) isomer 2 MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 282.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C18H19NO2 |
| InChI |
InChI=1S/C18H19NO2/c19-9-3-6-15-14-8-7-13(20)10-12(14)11-18(21)17-5-2-1-4-16(15)17/h1-2,4-8,10,18,20-21H,3,9,11,19H2/b15-6- |
| InChIKey |
KDJZARBUODJLSG-UUASQNMZSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
NCC\C=C/1C2=C(C(CC3=C1C=CC(=C3)O)O)C=CC=C2 |
| 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 |
ms2 |
| Technique |
ITMS |
