omeprazole_BTP_M1
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UoB-XB000901
Dataset description:
This MassBank record with Accession MSBNK-UoB-XB000901 contains the MS2 mass spectrum of omeprazole_BTP_M1 with the InChIkey IXEQEYRTSRFZEO-UHFFFAOYSA-N.
Source: omeprazole_BTP_M1; LC-ESI-FT; MS2; CE: 25,60,100%; R=17500; [M+H]+
Chemical Info
| InChI | InChI=1S/C17H19N3O4S/c1-10-8-18-15(11(2)16(10)24-4)9-25(21,22)17-19-13-6-5-12(23-3)7-14(13)20-17/h5-8H,9H2,1-4H3,(H,19,20) |
|---|---|
| SMILES | CC1=CN=C(C(=C1OC)C)CS(=O)(=O)C2=NC3=C(N2)C=C(C=C3)OC |
| InChI Key | IXEQEYRTSRFZEO-UHFFFAOYSA-N |
| Exact Mass | 361.110 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 | 53b1198c-ad3e-4866-8848-b0b0778c2e89 |
| Package id | msbnk-uob-xb000901 |
| Resource type | HTML |
| State | active |