| SpectraBase Spectrum ID |
CrQ17MRhSTo |
| Name |
Trospium-M (di-HO-methoxy-sulfate) 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 |
C26H32NO5 |
| InChI |
InChI=1S/C26H31NO5/c1-31-23-12-6-19(7-13-23)26(30,18-4-10-22(28)11-5-18)25(29)32-24-16-20-8-9-21(17-24)27(20)14-2-3-15-27/h4-7,10-13,20-21,24,30H,2-3,8-9,14-17H2,1H3/p+1/t20-,21+,24?,26? |
| InChIKey |
FUKDPMQHBRYKKS-UHFFFAOYSA-O |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OC(C1=CC=C(C=C1)O)(C1=CC=C(C=C1)OC)C(OC1C[C@@]2(CC[C@](C1)([N+]21CCCC1)[H])[H])=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 |
