TiaprideMet
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA002153
Dataset description:
This MassBank record with Accession MSBNK-Waters-WA002153 contains the MS mass spectrum of TiaprideMet with the InChIkey SMMXTJMPESFCOQ-UHFFFAOYSA-N.
Source: TiaprideMet
Chemical Info
| InChI | InChI=1S/C14H22N2O4S/c1-4-16(5-2)9-8-15-14(18)12-10-11(21(3,19)20)6-7-13(12)17/h6-7,10,17H,4-5,8-9H2,1-3H3,(H,15,18) |
|---|---|
| SMILES | CCN(CC)CCNC(=O)c(c(O)1)cc(cc1)S(C)(=O)=O |
| InChI Key | SMMXTJMPESFCOQ-UHFFFAOYSA-N |
| Molecular Formula | C14H22N2O4S |
| Exact Mass | 314.130 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 | cd4c2c11-736f-467e-b3a7-930017bf5641 |
| Package id | msbnk-waters-wa002153 |
| Resource type | HTML |
| State | active |