Acamprosate
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA001361
Dataset description:
This MassBank record with Accession MSBNK-Waters-WA001361 contains the MS mass spectrum of Acamprosate with the InChIkey AFCGFAGUEYAMAO-UHFFFAOYSA-N.
Source: Acamprosate
Chemical Info
| InChI | InChI=1S/C5H11NO4S/c1-5(7)6-3-2-4-11(8,9)10/h2-4H2,1H3,(H,6,7)(H,8,9,10) |
|---|---|
| SMILES | CC(=O)NCCCS(O)(=O)=O |
| InChI Key | AFCGFAGUEYAMAO-UHFFFAOYSA-N |
| Molecular Formula | C5H11NO4S |
| Exact Mass | 181.041 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 | 9258842c-ae7a-4acb-a05b-42b6ea5a71d9 |
| Package id | msbnk-waters-wa001361 |
| Resource type | HTML |
| State | active |