| SpectraBase Spectrum ID |
1Px9KduOkS6 |
| Name |
Celiprolol-M (HO-) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 396.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C20H33N3O5 |
| InChI |
InChI=1S/C20H33N3O5/c1-6-23(7-2)19(27)22-15-8-9-18(17(10-15)14(3)25)28-12-16(26)11-21-20(4,5)13-24/h8-10,16,21,24,26H,6-7,11-13H2,1-5H3,(H,22,27) |
| InChIKey |
SFXDLBAPLPMYDG-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OCC(C)(C)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 |
