@prefix bfo: <http://purl.obolibrary.org/obo/BFO_> .
@prefix chebi: <http://purl.obolibrary.org/obo/CHEBI_> .
@prefix chemdcatap: <https://w3id.org/nfdi-de/dcat-ap-plus/chemistry/> .
@prefix cheminf: <http://semanticscience.org/resource/CHEMINF_> .
@prefix chmo: <http://purl.obolibrary.org/obo/CHMO_> .
@prefix dcat: <http://www.w3.org/ns/dcat#> .
@prefix dct: <http://purl.org/dc/terms/> .
@prefix foaf: <http://xmlns.com/foaf/0.1/> .
@prefix ns1: <http://qudt.org/schema/qudt/> .
@prefix prov: <http://www.w3.org/ns/prov#> .
@prefix schema1: <http://schema.org/> .
@prefix sio: <http://semanticscience.org/resource/SIO_> .
@prefix xsd: <http://www.w3.org/2001/XMLSchema#> .

<https://doi.org/10.14272/NMKXBAXLUIDBSU-UHFFFAOYSA-N/CHMO0000601> a dcat:Dataset,
        chemdcatap:SubstanceSampleCharacterizationDataset ;
    dct:conformsTo [ a dct:Standard ;
            dct:identifier <https://docs.nmrxiv.org/submission-guides/data-model/spectra.html> ] ;
    dct:description """dataset for heteronuclear multiple bond coherence (HMBC)

""" ;
    dct:identifier "https://doi.org/10.14272/NMKXBAXLUIDBSU-UHFFFAOYSA-N/CHMO0000601" ;
    dct:language <http://id.loc.gov/vocabulary/iso639-1/en> ;
    dct:publisher <https://search.nfdi4chem.de/organization/5d8cf908-018e-4085-886f-62c28ac9772a> ;
    dct:subject <https://doi.org/10.14272/NMKXBAXLUIDBSU-UHFFFAOYSA-N/CHMO0000601#sample> ;
    dct:title "heteronuclear multiple bond coherence (HMBC)" ;
    prov:wasGeneratedBy <https://doi.org/10.14272/NMKXBAXLUIDBSU-UHFFFAOYSA-N/CHMO0000601#measurement> .

<http://id.loc.gov/vocabulary/iso639-1/en> a dct:LinguisticSystem .

chmo:0000601 a schema1:DefinedTerm ;
    schema1:name "heteronuclear multiple bond coherence" .

<https://doi.org/10.14272/NMKXBAXLUIDBSU-UHFFFAOYSA-N/CHMO0000601#measurement> a chmo:0000601,
        prov:Activity ;
    prov:used <https://doi.org/10.14272/NMKXBAXLUIDBSU-UHFFFAOYSA-N/CHMO0000601#sample> .

<https://pubchem.ncbi.nlm.nih.gov/compound/164889700> a chebi:23367 ;
    sio:000008 [ a cheminf:000018 ;
            dct:title "assigned SMILES" ;
            prov:value "Cc1ccc(cc1)Cn1c(c2ccccc2)c(c2c1cccc2)C(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F" ],
        [ a cheminf:000059 ;
            dct:title "assigned InChIKey" ;
            prov:value "NMKXBAXLUIDBSU-UHFFFAOYSA-N" ],
        [ a cheminf:000113 ;
            dct:title "assigned InChI" ;
            prov:value "InChI=1S/C30H18F15NO/c1-16-11-13-17(14-12-16)15-46-20-10-6-5-9-19(20)21(22(46)18-7-3-2-4-8-18)23(47)24(31,32)25(33,34)26(35,36)27(37,38)28(39,40)29(41,42)30(43,44)45/h2-14H,15H2,1H3" ],
        [ a cheminf:000107 ;
            dct:title "assigned IUPAC name" ;
            prov:value "2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-1-[1-[(4-methylphenyl)methyl]-2-phenylindol-3-yl]octan-1-one" ],
        [ a <http://purl.allotrope.org/ontologies/result#AFR_0002409> ;
            dct:title "assigned exact mass" ;
            ns1:hasQuantityKind <http://qudt.org/vocab/quantitykind/MolarMass> ;
            ns1:unit <https://qudt.org/vocab/unit/GM-PER-MOL> ;
            prov:value "693.4460679999997"^^xsd:float ],
        [ a cheminf:000042 ;
            dct:title "assigned IUPAC chemical formula" ;
            prov:value "C30H18F15NO" ] .

<https://search.nfdi4chem.de/organization/5d8cf908-018e-4085-886f-62c28ac9772a> a foaf:Organization ;
    foaf:name "Chemotion - Repository " .

<https://doi.org/10.14272/NMKXBAXLUIDBSU-UHFFFAOYSA-N/CHMO0000601#sample> a sio:001378 ;
    bfo:0000051 <https://pubchem.ncbi.nlm.nih.gov/compound/164889700> ;
    dct:title "evaluated sample" .