| SpectraBase Spectrum ID |
JzWA6PjdXvC |
| Name |
Gallopamil-M (demethyl-glucuronide) isomer 2 MS3_2 |
| Comments |
T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [80.00-345.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C19H29N2O3/c1-14(2)19(13-20,9-8-10-21(3)4)15-11-16(22-5)18(24-7)17(12-15)23-6/h11-12,14H,3,8-10H2,1-2,4-7H3/q+1 |
| InChIKey |
OOJRQFXUZYIDOW-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
C=[N+](CCCC(C=1C=C(C(=C(C1)OC)OC)OC)(C#N)C(C)C)C |
| 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 |
