@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 prov: <http://www.w3.org/ns/prov#> .
@prefix schema1: <http://schema.org/> .
@prefix xsd: <http://www.w3.org/2001/XMLSchema#> .

<https://doi.org/10.57992/nmrxiv.p150.s1512.d6655> a dcat:Dataset ;
    dct:conformsTo [ a dct:Standard ;
            dct:identifier <https://docs.nmrxiv.org/submission-guides/data-model/spectra.html> ],
        [ a dct:Standard ] ;
    dct:creator [ a foaf:Agent ;
            foaf:name "NA" ] ;
    dct:description "No description" ;
    dct:identifier "https://doi.org/10.57992/nmrxiv.p150.s1512.d6655" ;
    dct:issued "2025-12-17"^^xsd:date ;
    dct:language <http://id.loc.gov/vocabulary/iso639-1/en> ;
    dct:modified "2025-12-17"^^xsd:date ;
    dct:publisher <https://search.nfdi4chem.de/organization/14e443f8-70e7-497d-9785-3727d79901ab> ;
    dct:subject <https://doi.org/10.57992/nmrxiv.p150.s1512.d6655/sample> ;
    dct:title "16[3 COSY]" ;
    dcat:landingPage <https://nmrxiv.org/D6655> ;
    prov:wasGeneratedBy <https://doi.org/10.57992/nmrxiv.p150.s1512.d6655/analysis> .

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

<http://purl.allotrope.org/ontologies/process#AFP_0003618> a schema1:DefinedTerm ;
    schema1:name "peak identification" .

chmo:0000599 a schema1:DefinedTerm ;
    schema1:name "correlation spectroscopy" .

chmo:0000800 a schema1:DefinedTerm ;
    schema1:name "spectrum" .

<https://doi.org/10.57992/nmrxiv.p150.s1512.d6655/analysis> a <http://purl.allotrope.org/ontologies/process#AFP_0003618>,
        prov:Activity ;
    prov:used <https://doi.org/10.57992/nmrxiv.p150.s1512.d6655/spectrum> .

<https://doi.org/10.57992/nmrxiv.p150.s1512.d6655/measurement> a chmo:0000599,
        prov:Activity .

<https://doi.org/10.57992/nmrxiv.p150.s1512.d6655/sample> a prov:Entity ;
    dct:relation [ a cheminf:000018,
                prov:Entity ;
            dct:title "assigned SMILES" ;
            prov:value "CC1(C)C(=O)CC[C@]2(C)[C@H]3CC[C@@H]4[C@@]5(O)CCC(=O)[C@H]5CC[C@@]4(C)[C@]3(C)CC[C@@H]12" ],
        [ a cheminf:000059,
                prov:Entity ;
            dct:title "assigned InChiKey" ;
            prov:value "AQOGCTCYWIVIRZ-ZTRGCLQGSA-N" ],
        [ a cheminf:000018,
                prov:Entity ;
            dct:title "assigned SMILES" ;
            prov:value "CC1(C)C(=O)CC[C@]2(C)[C@H]3CC[C@@H]4[C@@]5(O)CCC(=O)[C@H]5CC[C@@]4(C)[C@]3(C)CC[C@@H]12" ],
        [ a cheminf:000037,
                prov:Entity ;
            dct:title "assigned IUPACChemicalFormula" ;
            prov:value "not available" ],
        [ a cheminf:000113,
                prov:Entity ;
            dct:title "assigned InChi" ;
            prov:value "InChI=1S/C26H40O3/c1-22(2)18-10-14-24(4)19(23(18,3)12-11-21(22)28)6-7-20-25(24,5)13-8-16-17(27)9-15-26(16,20)29/h16,18-20,29H,6-15H2,1-5H3/t16-,18+,19-,20+,23+,24-,25-,26-/m1/s1" ],
        [ a cheminf:000113,
                prov:Entity ;
            dct:title "assigned InChi" ;
            prov:value "InChI=1S/C26H40O3/c1-22(2)18-10-14-24(4)19(23(18,3)12-11-21(22)28)6-7-20-25(24,5)13-8-16-17(27)9-15-26(16,20)29/h16,18-20,29H,6-15H2,1-5H3/t16-,18+,19-,20+,23+,24-,25-,26-/m1/s1" ],
        [ a cheminf:000037,
                prov:Entity ;
            dct:title "assigned IUPACChemicalFormula" ;
            prov:value "not available" ],
        [ a cheminf:000059,
                prov:Entity ;
            dct:title "assigned InChiKey" ;
            prov:value "AQOGCTCYWIVIRZ-ZTRGCLQGSA-N" ] .

<https://doi.org/10.57992/nmrxiv.p150.s1512.d6655/spectrum> a chmo:0000800,
        prov:Entity ;
    prov:wasGeneratedBy <https://doi.org/10.57992/nmrxiv.p150.s1512.d6655/measurement> .

<https://nmrxiv.org/D6655> a foaf:Document .

<https://search.nfdi4chem.de/organization/14e443f8-70e7-497d-9785-3727d79901ab> a foaf:Organization ;
    foaf:name "nmrXiv" .

cheminf:000018 a schema1:DefinedTerm ;
    schema1:name "SMILES" .

cheminf:000037 a schema1:DefinedTerm ;
    schema1:name "IUPACChemicalFormula" .

cheminf:000059 a schema1:DefinedTerm ;
    schema1:name "InChiKey" .

cheminf:000113 a schema1:DefinedTerm ;
    schema1:name "InChi" .