| SpectraBase Spectrum ID |
6eohJiojui |
| Name |
Dronedarone MS3_1 |
| Comments |
T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [120.00-515.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C27H36N2O5S/c1-4-6-9-25-26(23-19-21(29-35(3,31)32)12-15-24(23)34-25)27(30)20-10-13-22(14-11-20)33-18-8-17-28-16-7-5-2/h10-15,19,28-29H,4-9,16-18H2,1-3H3/p+1 |
| InChIKey |
IJVZZGIAELTWBB-UHFFFAOYSA-O |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
[NH2+](CCCOC1=CC=C(C(C=2C3=CC(=CC=C3OC2CCCC)NS(=O)(=O)C)=O)C=C1)CCCC |
| 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: Parent |
| Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type |
ms3 |
| Technique |
ITMS |
