| SpectraBase Spectrum ID |
6oxC0DEF3g |
| Name |
Acebutolol-M (N-dealkyl-) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 295.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C15H22N2O4 |
| InChI |
InChI=1S/C15H22N2O4/c1-3-4-15(20)17-11-5-6-14(13(7-11)10(2)18)21-9-12(19)8-16/h5-7,12,19H,3-4,8-9,16H2,1-2H3,(H,17,20) |
| InChIKey |
SYTNMIAHURUHAG-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
NCC(COC=1C=CC(NC(=O)CCC)=CC1C(C)=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 |
