omeprazole_BTP_M4
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UoB-XB000903
Dataset description:
This MassBank record with Accession MSBNK-UoB-XB000903 contains the MS2 mass spectrum of omeprazole_BTP_M4 with the InChIkey ZBGMHRIYIGAEGJ-UHFFFAOYSA-N.
Source: omeprazole_BTP_M4
Chemical Info
| InChI | InChI=1S/C17H19N3O5S/c1-10-8-20(21)15(11(2)16(10)25-4)9-26(22,23)17-18-13-6-5-12(24-3)7-14(13)19-17/h5-8H,9H2,1-4H3,(H,18,19) |
|---|---|
| SMILES | CC1=C[N+](=C(C(=C1OC)C)CS(=O)(=O)C2=NC3=C(N2)C=C(C=C3)OC)[O-] |
| InChI Key | ZBGMHRIYIGAEGJ-UHFFFAOYSA-N |
| Molecular Formula | C17H19N3O5S |
| Exact Mass | 377.104 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 | 38e014e2-78d0-4778-9148-3d73bb548ef4 |
| Package id | msbnk-uob-xb000903 |
| Resource type | HTML |
| State | active |