@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 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 obi: <http://purl.obolibrary.org/obo/OBI_> .
@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/10.57992/nmrxiv.p68.s502.d2482> a dcat:Dataset,
        chemdcatap:SubstanceSampleCharacterizationDataset ;
    dct:conformsTo [ a dct:Standard ;
            dct:identifier <https://docs.nmrxiv.org/submission-guides/data-model/spectra.html> ] ;
    dct:description "This dataset contains NMR spectra obtained for the sample -High Res 10 kDa date: 2018-12-21T11:54:32.000Z isFt: true name: High Res 10 kDa/10 phc0: -244.42 phc1: 0 type: NMR Spectrum DECIM: 1664 aqMod: 3 isFid: false tdOff: 0 title: Parameter file, TopSpin 3.5 pl 7 DSPFVS: 21 nucleus: 1H reverse: false solvent: D2O dimension: 1 increment: 3.75457845376695 isComplex: true probeName: Z116098_0618 (PA BBO 400S1 BBF-H-D-05 Z SP) experiment: 1d groupDelay: 76 temperature: 298.1596 spectrumSize: 131072 baseFrequency: 400.15 fieldStrength: 9.398161044985478 numberOfScans: 16 pulseSequence: zg30 spectralWidth: 30.0366276301356 numberOfPoints: 9 relaxationTime: 0.1 acquisitionTime: 0.00033280000000005693 frequencyOffset: 2471.084000035262 originFrequency: 400.152471084 pulseStrength90: 25000 experimentNumber: 10 linearPredictionBin: 0 lpNumberOfCoefficients: 0 windowMultiplicationMode: 1 date: 2018-12-21T12:59:02.000Z isFt: true name: High Res 10 kDa/11 phc0: 17.38403,0 phc1: 0,0 type: NMR Spectrum DECIM: 2432 aqMod: 3 isFid: false tdOff: 0,0 title: Parameter file, TopSpin 3.5 pl 7 DSPFVS: 21 nucleus: 1H,1H reverse: false,false solvent: D2O dimension: 2 increment: 3.4252334934258 isComplex: false probeName: Z116098_0618 (PA BBO 400S1 BBF-H-D-05 Z SP) experiment: null groupDelay: 76 temperature: 298.0009 spectrumSize: 32768,1024 baseFrequency: 400.15,400.15 fieldStrength: 9.398161044985478 numberOfScans: 10 pulseSequence: ledbpgp2s spectralWidth: 20.5514009605548,20.6192273663652 numberOfPoints: 7 relaxationTime: 5 acquisitionTime: 0.00036479999999999916 frequencyOffset: 2000.650000013593,2000.650000013593 originFrequency: 400.15200065,400.15200065 pulseStrength90: 25000 experimentNumber: 11 acquisitionScheme: notPhaseSensitive linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 1,0 date: 2018-12-29T10:04:45.000Z isFt: true name: High Res 10 kDa/12 phc0: 17.38403,0 phc1: 0,0 type: NMR Spectrum DECIM: 2432 aqMod: 3 isFid: false tdOff: 0,0 title: Parameter file, TopSpin 3.5 pl 7 DSPFVS: 21 nucleus: 1H,1H reverse: false,false solvent: D2O dimension: 2 increment: 3.4252334934258 isComplex: false probeName: Z116098_0618 (PA BBO 400S1 BBF-H-D-05 Z SP) experiment: null groupDelay: 76 temperature: 298.0012 spectrumSize: 32768,1024 baseFrequency: 400.15,400.15 fieldStrength: 9.398161044985478 numberOfScans: 8 pulseSequence: ledbpgp2s spectralWidth: 20.5514009605548,20.6192273663652 numberOfPoints: 7 relaxationTime: 5 acquisitionTime: 0.00036479999999999916 frequencyOffset: 2000.650000013593,2000.650000013593 originFrequency: 400.15200065,400.15200065 pulseStrength90: 25000 experimentNumber: 12 acquisitionScheme: notPhaseSensitive linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 1,0 date: 2018-12-29T10:25:37.000Z isFt: true name: High Res 10 kDa/13 phc0: 17.38403,0 phc1: 0,0 type: NMR Spectrum DECIM: 2432 aqMod: 3 isFid: false tdOff: 0,0 title: Parameter file, TopSpin 3.5 pl 7 DSPFVS: 21 nucleus: 1H,1H reverse: false,false solvent: D2O dimension: 2 increment: 3.4252334934258 isComplex: false probeName: Z116098_0618 (PA BBO 400S1 BBF-H-D-05 Z SP) experiment: null groupDelay: 76 temperature: 298.0028 spectrumSize: 32768,1024 baseFrequency: 400.15,400.15 fieldStrength: 9.398161044985478 numberOfScans: 8 pulseSequence: ledbpgp2s spectralWidth: 20.5514009605548,20.6192273663652 numberOfPoints: 7 relaxationTime: 5 acquisitionTime: 0.00036479999999999916 frequencyOffset: 2000.650000013593,2000.650000013593 originFrequency: 400.15200065,400.15200065 pulseStrength90: 25000 experimentNumber: 13 acquisitionScheme: notPhaseSensitive linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 1,0 date: 2018-12-29T10:41:57.000Z isFt: true name: High Res 10 kDa/14 phc0: 17.38403,0 phc1: 0,0 type: NMR Spectrum DECIM: 2432 aqMod: 3 isFid: false tdOff: 0,0 title: Parameter file, TopSpin 3.5 pl 7 DSPFVS: 21 nucleus: 1H,1H reverse: false,false solvent: D2O dimension: 2 increment: 3.4252334934258 isComplex: false probeName: Z116098_0618 (PA BBO 400S1 BBF-H-D-05 Z SP) experiment: null groupDelay: 76 temperature: 298.0012 spectrumSize: 32768,1024 baseFrequency: 400.15,400.15 fieldStrength: 9.398161044985478 numberOfScans: 16 pulseSequence: ledbpgp2s spectralWidth: 20.5514009605548,20.6192273663652 numberOfPoints: 7 relaxationTime: 5 acquisitionTime: 0.00036479999999999916 frequencyOffset: 2000.650000013593,2000.650000013593 originFrequency: 400.15200065,400.15200065 pulseStrength90: 25000 experimentNumber: 14 acquisitionScheme: notPhaseSensitive linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 1,0 date: 2018-12-29T11:31:02.000Z isFt: true name: High Res 10 kDa/15 phc0: 17.38403,0 phc1: 0,0 type: NMR Spectrum DECIM: 2432 aqMod: 3 isFid: false tdOff: 0,0 title: Parameter file, TopSpin 3.5 pl 7 DSPFVS: 21 nucleus: 1H,1H reverse: false,false solvent: D2O dimension: 2 increment: 3.4252334934258 isComplex: false probeName: Z116098_0618 (PA BBO 400S1 BBF-H-D-05 Z SP) experiment: null groupDelay: 76 temperature: 298.0029 spectrumSize: 32768,1024 baseFrequency: 400.15,400.15 fieldStrength: 9.398161044985478 numberOfScans: 8 pulseSequence: ledbpgp2s spectralWidth: 20.5514009605548,20.6192273663652 numberOfPoints: 7 relaxationTime: 5 acquisitionTime: 0.00036479999999999916 frequencyOffset: 2000.650000013593,2000.650000013593 originFrequency: 400.15200065,400.15200065 pulseStrength90: 25000 experimentNumber: 15 acquisitionScheme: notPhaseSensitive linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 1,0 date: 2018-12-29T12:59:47.000Z isFt: true name: High Res 10 kDa/16 phc0: 17.38403,0 phc1: 0,0 type: NMR Spectrum DECIM: 2432 aqMod: 3 isFid: false tdOff: 0,0 title: Parameter file, TopSpin 3.5 pl 7 DSPFVS: 21 nucleus: 1H,1H reverse: false,false solvent: D2O dimension: 2 increment: 3.4252334934258 isComplex: false probeName: Z116098_0618 (PA BBO 400S1 BBF-H-D-05 Z SP) experiment: null groupDelay: 76 temperature: 297.9986 spectrumSize: 32768,1024 baseFrequency: 400.15,400.15 fieldStrength: 9.398161044985478 numberOfScans: 8 pulseSequence: ledbpgp2s spectralWidth: 20.5514009605548,20.6192273663652 numberOfPoints: 7 relaxationTime: 5 acquisitionTime: 0.00036479999999999916 frequencyOffset: 2000.650000013593,2000.650000013593 originFrequency: 400.15200065,400.15200065 pulseStrength90: 25000 experimentNumber: 16 acquisitionScheme: notPhaseSensitive linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 1,0 date: 2018-12-29T12:59:47.000Z isFt: true name: High Res 10 kDa/161 phc0: 17.38403,0 phc1: 0,0 type: NMR Spectrum DECIM: 2432 aqMod: 3 isFid: false tdOff: 0,0 title: Parameter file, TopSpin 3.6.2 DSPFVS: 21 nucleus: 1H,1H reverse: false,false solvent: D2O dimension: 2 increment: null isComplex: false probeName: Z116098_0618 (PA BBO 400S1 BBF-H-D-05 Z SP) experiment: null groupDelay: 76 temperature: 297.9986 spectrumSize: 32768,1024 baseFrequency: 400.15,400.15 fieldStrength: 9.398161044985478 numberOfScans: 8 pulseSequence: ledbpgp2s spectralWidth: 20.5514009605548,20.6192273663652 numberOfPoints: 1 relaxationTime: 5 acquisitionTime: 0 frequencyOffset: 2000.650000013593,2000.650000013593 originFrequency: 400.15200065,400.15200065 pulseStrength90: 25000 experimentNumber: 161 acquisitionScheme: notPhaseSensitive linearPredictionBin: 0,0 lpNumberOfCoefficients: 0,0 windowMultiplicationMode: 1,0" ;
    dct:identifier "https://doi.org/10.57992/nmrxiv.p68.s502.d2482" ;
    dct:language <http://id.loc.gov/vocabulary/iso639-1/en> ;
    dct:publisher <https://search.nfdi4chem.de/organization/14e443f8-70e7-497d-9785-3727d79901ab> ;
    dct:subject <https://doi.org/10.57992/nmrxiv.p68.s502.d2482#sample> ;
    dct:title "High Res 10 kDa[13]" ;
    prov:wasGeneratedBy <https://doi.org/10.57992/nmrxiv.p68.s502.d2482#measurement> .

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

obi:0000070 a schema1:DefinedTerm ;
    schema1:name "assay" .

<https://doi.org/10.57992/nmrxiv.p68.s502.d2482#measurement> a obi:0000070,
        prov:Activity ;
    prov:used <https://doi.org/10.57992/nmrxiv.p68.s502.d2482#sample> .

<https://pubchem.ncbi.nlm.nih.gov/compound/66412> a chebi:23367 ;
    sio:000008 [ a cheminf:000113 ;
            dct:title "assigned InChI" ;
            prov:value "InChI=1S/C5H9NO/c1-2-5-6-3-4-7-5/h2-4H2,1H3" ],
        [ a cheminf:000059 ;
            dct:title "assigned InChIKey" ;
            prov:value "NYEZZYQZRQDLEH-UHFFFAOYSA-N" ],
        [ 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 "99.13"^^xsd:float ],
        [ a cheminf:000018 ;
            dct:title "assigned SMILES" ;
            prov:value "CCC1=NCCO1" ],
        [ a cheminf:000042 ;
            dct:title "assigned IUPAC chemical formula" ;
            prov:value "C5H9NO" ] .

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

<https://doi.org/10.57992/nmrxiv.p68.s502.d2482#sample> a sio:001378 ;
    bfo:0000051 <https://pubchem.ncbi.nlm.nih.gov/compound/66412> ;
    dct:title "evaluated sample" .