Dronedarone
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EA285507
Dataset description:
This MassBank record with Accession MSBNK-Eawag-EA285507 contains the MS2 mass spectrum of Dronedarone with the InChIkey ZQTNQVWKHCQYLQ-UHFFFAOYSA-N.
Source: Dronedarone
Chemical Info
| InChI | InChI=1S/C31H44N2O5S/c1-5-8-12-29-30(27-23-25(32-39(4,35)36)15-18-28(27)38-29)31(34)24-13-16-26(17-14-24)37-22-11-21-33(19-9-6-2)20-10-7-3/h13-18,23,32H,5-12,19-22H2,1-4H3 |
|---|---|
| SMILES | CS(=O)(=O)Nc1cc2c(c(oc2cc1)CCCC)C(c1ccc(cc1)OCCCN(CCCC)CCCC)=O |
| InChI Key | ZQTNQVWKHCQYLQ-UHFFFAOYSA-N |
| Molecular Formula | C31H44N2O5S |
| Exact Mass | 556.297 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | January 11, 2024 |
| Metadata last updated | January 11, 2024 |
| Created | January 11, 2024 |
| Format | HTML |
| License | Attribution 4.0 International (CC BY 4.0) |
| Id | 6d9294ed-a524-4a4e-b8d9-d53e5f69765f |
| Package id | msbnk-eawag-ea285507 |
| Resource type | HTML |
| State | active |