| SpectraBase Spectrum ID |
8znIWqWRDk |
| Name |
Celiprolol-M (N-dealkyl-) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 324.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C16H25N3O4 |
| InChI |
InChI=1S/C16H25N3O4/c1-4-19(5-2)16(22)18-12-6-7-15(14(8-12)11(3)20)23-10-13(21)9-17/h6-8,13,21H,4-5,9-10,17H2,1-3H3,(H,18,22) |
| InChIKey |
LIBXHPWWYKAQGO-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
NCC(COC1=CC=C(C=C1C(C)=O)NC(N(CC)CC)=O)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 |
ms2 |
| Technique |
ITMS |
