| SpectraBase Spectrum ID |
HNVFMV8qX0u |
| Name |
Maprotiline-M (di-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. |
| Formula |
C20H23NO2 |
| InChI |
InChI=1S/C20H23NO2/c1-21-12-13(22)11-20-17-8-4-2-6-14(17)16(10-19(20)23)15-7-3-5-9-18(15)20/h2-9,13,16,19,21-23H,10-12H2,1H3/t13?,16-,19-,20+/m1/s1 |
| InChIKey |
JLRZVSMXIDISGO-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
O[C@@]1(C[C@]2(C3=C([C@]1(CC(CNC)O)C=1C2=CC=CC1)C=CC=C3)[H])[H] |
| 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 |
