| SpectraBase Spectrum ID |
EA0ABbQNaeO |
| Name |
Esmolol-M (HO-) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 312.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C16H25NO5 |
| InChI |
InChI=1S/C16H25NO5/c1-11(2)17-9-13(18)10-22-14-6-4-12(15(19)8-14)5-7-16(20)21-3/h4,6,8,11,13,17-19H,5,7,9-10H2,1-3H3 |
| InChIKey |
YZBACKNPPQVYHR-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
N(C(C)C)CC(COC1=CC(=C(C=C1)CCC(OC)=O)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 |
