| SpectraBase Spectrum ID |
KbzmOReu4wq |
| Name |
Metipranolol-M (HO-) isomer 1 MS3_1 |
| Comments |
T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [60.00-280.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C14H20NO4/c1-9-7-13(19-11(3)17)10(2)12(8-16)14(9)18-6-4-5-15/h4,7,16H,5-6,8,15H2,1-3H3/q+1 |
| InChIKey |
OWNJBVCKSJSDFR-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
NC[CH+]COC1=C(CO)C(=C(C=C1C)OC(=O)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 |
