@prefix adms: . @prefix bfo: . @prefix chebi: . @prefix cheminf: . @prefix dcat: . @prefix dcatap: . @prefix dct: . @prefix foaf: . @prefix obi: . @prefix prov: . @prefix schema1: . @prefix sio: . @prefix skos: . @prefix xsd: . a dcat:Dataset ; dcatap:applicableLegislation ; dct:conformsTo [ a dct:Standard ; dct:description "https://w3id.org/nfdi-de/dcat-ap-plus/chemistry/" ; dct:title "ChemDCAT-AP" ] ; dct:creator [ a foaf:Agent ; dct:type [ a skos:Concept ; dct:description "A human being." ; skos:prefLabel "person" ] ; foaf:name "Frolov A" ], [ a foaf:Agent ; dct:type [ a skos:Concept ; dct:description "A human being." ; skos:prefLabel "person" ] ; foaf:name "Bathe U" ], [ a foaf:Agent ; dct:type [ a skos:Concept ; dct:description "A human being." ; skos:prefLabel "person" ] ; foaf:name "Dawid C" ], [ a foaf:Agent ; dct:type [ a skos:Concept ; dct:description "A human being." ; skos:prefLabel "person" ] ; foaf:name "Tissier A." ], [ a foaf:Agent ; dct:type [ a skos:Concept ; dct:description "A human being." ; skos:prefLabel "person" ] ; foaf:name "Soboleva A" ], [ a foaf:Agent ; dct:type [ a skos:Concept ; dct:description "A human being." ; skos:prefLabel "person" ] ; foaf:name "Schmidt J" ], [ a foaf:Agent ; dct:type [ a skos:Concept ; dct:description "A human being." ; skos:prefLabel "person" ] ; foaf:name "Frank O" ] ; dct:description "This dataset contains NMR spectra obtained for the sample -of_20220728_DT4 date: 2022-08-01T09:51:03.000Z isFt: false name: of_20220728_DT4/20 phc0: -80.20317 phc1: 3.329678 type: NMR FID DECIM: 2000 aqMod: 3 isFid: true tdOff: 0 title: Parameter file, TopSpin 4.1.1 DSPFVS: 21 nucleus: 1H reverse: false solvent: MeOD dimension: 1 increment: 0.00005000000000000004 isComplex: true probeName: Z168379_0001 (CP2.1 TCI 500S2 H-C/N-D-05 Z XT) experiment: 1d groupDelay: 76 temperature: 299.997 spectrumSize: 65536 baseFrequency: 500.13 digitalFilter: 76 fieldStrength: 11.746350827011339 numberOfScans: 16 pulseSequence: zg30 spectralWidth: 19.9946778845426 numberOfPoints: 5 relaxationTime: 1 acquisitionTime: 0.00020000000000000017 frequencyOffset: 3088.3019999805583 originFrequency: 500.133088302 pulseStrength90: 31250 experimentNumber: 20 acquisitionScheme: 0 linearPredictionBin: 0 lpNumberOfCoefficients: 0 windowMultiplicationMode: 1 date: 2022-08-01T09:51:03.000Z isFt: true name: of_20220728_DT4/20 phc0: -80.20317 phc1: 3.329678 type: NMR Spectrum DECIM: 2000 aqMod: 3 isFid: false tdOff: 0 title: Parameter file, TopSpin 4.1.1 DSPFVS: 21 nucleus: 1H reverse: false solvent: MeOD dimension: 1 increment: 4.99866947113565 isComplex: true probeName: Z168379_0001 (CP2.1 TCI 500S2 H-C/N-D-05 Z XT) experiment: 1d groupDelay: 76 temperature: 299.997 spectrumSize: 65536 baseFrequency: 500.13 fieldStrength: 11.746350827011339 numberOfScans: 16 pulseSequence: zg30 spectralWidth: 19.9946778845426 numberOfPoints: 5 relaxationTime: 1 acquisitionTime: 0.00020000000000000017 frequencyOffset: 3088.3019999805583 originFrequency: 500.133088302 pulseStrength90: 31250 experimentNumber: 20 acquisitionScheme: 0 linearPredictionBin: 0 lpNumberOfCoefficients: 0 windowMultiplicationMode: 1 date: 2022-08-01T21:31:30.000Z isFt: false name: of_20220728_DT4/21 phc0: -75.95488,90 phc1: 0.85,-180 type: NMR FID DECIM: 4000 aqMod: 3 isFid: true tdOff: 0,0 title: Parameter file, TopSpin 4.1.1 DSPFVS: 21 nucleus: 1H,1H reverse: false,false solvent: MeOD dimension: 2 increment: 0.00010000000000000002 isComplex: true probeName: Z168379_0001 (CP2.1 TCI 500S2 H-C/N-D-05 Z XT) experiment: noesy groupDelay: 76 temperature: 299.9951 spectrumSize: 1024,1024 baseFrequency: 500.13,500.13 digitalFilter: 76 fieldStrength: 11.746350827011339 numberOfScans: 16 pulseSequence: noesygpph spectralWidth: 9.99735368824196,9.99735368824196 numberOfPoints: 5 relaxationTime: 2 acquisitionTime: 0.0004000000000000001 frequencyOffset: 2350.6119999865405,2350.6119999865405 originFrequency: 500.132350612,500.132350612 pulseStrength90: 31250 experimentNumber: 21 acquisitionScheme: TPPI linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 4,4" ; dct:identifier "https://doi.org/10.57992/nmrxiv.p56.s310.d1807" ; dct:issued "2024-04-22"^^xsd:date ; dct:language [ a dct:LinguisticSystem ; dct:description "http://id.loc.gov/vocabulary/iso639-1/en" ; dct:title "en" ] ; dct:modified "2025-12-17"^^xsd:date ; dct:publisher [ a foaf:Agent ; dct:type [ a skos:Concept ; dct:description "http://purl.org/adms/publishertype/Academia-ScientificOrganisation" ; skos:prefLabel "Academia/Scientific organisation" ] ; foaf:name "nmrXiv" ] ; dct:subject ; dct:title "of_20220728_DT4[21]" ; adms:identifier [ a adms:Identifier ; dct:description "The DOI of this dataset" ; dct:title "DOI" ; skos:notation "10.57992/nmrxiv.p56.s310.d1807" ], [ a adms:Identifier ; dct:description "The id of this dataset within the NFDI4Chem Search Service (https://search.nfdi4chem.de/)" ; dct:title "Search Service ID" ; skos:notation "https://search.nfdi4chem.de/dataset/nmrxiv-d1807" ] ; dcat:landingPage ; prov:wasGeneratedBy . obi:0000070 a schema1:DefinedTerm ; schema1:name "noesy" . a ; dct:title "Attribution 4.0 International" . a obi:0000070, prov:Activity ; dct:description "The kind of activity/process used to generate the dataset" ; prov:used . a chebi:23367 ; sio:000008 [ a cheminf:000113 ; dct:title "assigned InChI" ; prov:value "InChI=1S/C20H32O/c1-7-14(2)9-10-16-15(3)13-17(21)18-19(4,5)11-8-12-20(16,18)6/h7,9,16-18,21H,1,3,8,10-13H2,2,4-6H3" ], [ a cheminf:000018 ; dct:title "assigned SMILES" ; prov:value "C=CC(C)=CCC1C(=C)CC(O)C2C(C)(C)CCCC12C" ], [ a cheminf:000059 ; dct:title "assigned InChIKey" ; prov:value "BTZUXQVFYYTGIH-UHFFFAOYSA-N" ] . a foaf:Document . a sio:001378 ; bfo:0000051 ; dct:title "evaluated sample" .