Dataset

omeprazole_BTP_M1

This MassBank record with Accession MSBNK-UoB-XB000901 contains the MS2 mass spectrum of omeprazole_BTP_M1 with the InChIkey IXEQEYRTSRFZEO-UHFFFAOYSA-N.

Chemical Info

molecular Image
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
Molecular Formula C17H19N3O4S
Exact Mass 361.110 g/mol

Data and Resources

Metadata Information

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DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UoB-XB000901
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MetadataCreated 2024-01-11T22:09:24.184364
MetadataModified 2025-02-09T19:56:06.442990
MetadataPublished 2023-05-03
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