| SpectraBase Spectrum ID |
6SjioO9PqzO |
| Name |
Protriptyline-M (nor-HO-ring) MS3_1 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-250.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C17H18N/c1-14-8-5-6-11-16(14)17(12-7-13-18)15-9-3-2-4-10-15/h2-6,8-12H,1,7,13,18H2/q+1/b17-12+ |
| InChIKey |
XEPLPORAXWGCEY-SFQUDFHCSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
NCC\C=C/(C1=CC=CC=C1)C1=C([CH2+])C=CC=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 |
