| SpectraBase Spectrum ID |
3BHduz9BSQn |
| Name |
Dronedarone-M (HO-) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 573.40 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C31H44N2O6S |
| InChI |
InChI=1S/C31H44N2O6S/c1-5-7-18-33(19-8-6-2)20-9-21-38-26-14-11-24(12-15-26)31(35)30-27-22-25(32-40(4,36)37)13-17-28(27)39-29(30)16-10-23(3)34/h11-15,17,22-23,32,34H,5-10,16,18-21H2,1-4H3 |
| InChIKey |
XFUQUXLSRQTFOK-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
N(C=1C=C2C(OC(CCC(C)O)=C2C(C2=CC=C(C=C2)OCCCN(CCCC)CCCC)=O)=CC1)S(=O)(=O)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 |
ms2 |
| Technique |
ITMS |
