Bumetanide
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA001778
Dataset description:
This MassBank record with Accession MSBNK-Waters-WA001778 contains the MS mass spectrum of Bumetanide with the InChIkey MAEIEVLCKWDQJH-UHFFFAOYSA-N.
Source: Bumetanide
Chemical Info
| InChI | InChI=1S/C17H20N2O5S/c1-2-3-9-19-14-10-12(17(20)21)11-15(25(18,22)23)16(14)24-13-7-5-4-6-8-13/h4-8,10-11,19H,2-3,9H2,1H3,(H,20,21)(H2,18,22,23) |
|---|---|
| SMILES | CCCCNc(c1)c(Oc(c2)cccc2)c(cc(C(O)=O)1)S(N)(=O)=O |
| InChI Key | MAEIEVLCKWDQJH-UHFFFAOYSA-N |
| Molecular Formula | C17H20N2O5S |
| Exact Mass | 364.109 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-NonCommercial 4.0 International (CC BY-NC 4.0) |
| Id | b7f16b87-d9c4-467d-a1c3-a5c96c0c28e3 |
| Package id | msbnk-waters-wa001778 |
| Resource type | HTML |
| State | active |