@prefix schema: <http://schema.org/> .

<https://search.nfdi4chem.de/dataset/msbnk-casmi_2016-sm854101> a schema:Dataset ;
    schema:dateModified "2025-07-14T15:24:42.097524" ;
    schema:datePublished "2024-01-11T12:45:07.693952" ;
    schema:description "This MassBank record with Accession MSBNK-CASMI_2016-SM854101 contains the MS2 mass spectrum of Orlistat with the InChIkey AHLBNYSZXLDEJQ-FWEHEUNISA-N." ;
    schema:distribution <https://search.nfdi4chem.de/dataset/msbnk-casmi_2016-sm854101/resource/d3aa8af0-7361-409c-9412-1819d8daf480> ;
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    schema:keywords "InChI=1S/C29H53NO5/c1-5-7-9-11-12-13-14-15-16-18-24(34-29(33)26(30-22-31)20-23(3)4)21-27-25(28(32)35-27)19-17-10-8-6-2/h22-27H,5-21H2,1-4H3,(H,30,31)/t24-,25-,26-,27-/m0/s1" ;
    schema:license "https://creativecommons.org/licenses/by/4.0" ;
    schema:name "Orlistat; LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+" ;
    schema:publisher <https://search.nfdi4chem.de/organization/156e8074-ae7b-4094-83cb-afb3529824c4> ;
    schema:url "https://search.nfdi4chem.de/dataset/msbnk-casmi_2016-sm854101" .

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    schema:encodingFormat "HTML" ;
    schema:name "Orlistat" ;
    schema:url "https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-CASMI_2016-SM854101" .

<https://search.nfdi4chem.de/organization/156e8074-ae7b-4094-83cb-afb3529824c4> a schema:Organization ;
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