Flow object JSON
{
"flow_object_id": "fo-6241f9f0909b1dcb",
"prefLabel": [
{
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"@language": "en",
"@lang": "en",
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],
"prov:wasDerivedFrom": "legacy name field"
}
}
],
"altLabel": [
{
"@value": "Benzonitrile, 3,4-dichloro-",
"@language": "en",
"@lang": "en",
"provenance": {
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
}
],
"properties": {
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"@value": [
"C7H3Cl2N"
],
"attested_by": {
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},
"rdfs:label": "Molecular formula",
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{
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],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
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"prov:hadPrimarySource": [
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}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"KUWBYWUSERRVQP-UHFFFAOYSA-N"
],
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},
"rdfs:label": "InChIKey",
"provenance": [
{
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},
{
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"prov:hadPrimarySource": [
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]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
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"rdfs:label": "SMILES",
"@value": [
"N#Cc1ccc(Cl)c(Cl)c1"
],
"provenance": [
{
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]
},
{
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]
}
],
"attested_by": {
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]
}
},
"https://w3id.org/chemrof/inchi2d_string": {
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"rdfs:label": "InChI",
"@value": [
"InChI=1S/C7H3Cl2N/c8-6-2-1-5(4-10)3-7(6)9/h1-3H"
],
"provenance": [
{
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]
},
{
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]
}
],
"attested_by": {
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}
},
"https://w3id.org/chemrof/IUPAC_name": {
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"rdfs:label": "IUPAC name",
"@value": [
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],
"provenance": {
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"prov:hadPrimarySource": [
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]
},
"attested_by": {
"3,4-dichlorobenzonitrile": [
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]
}
},
"https://w3id.org/chemrof/molecular_mass": {
"@id": "https://w3id.org/chemrof/molecular_mass",
"rdfs:label": "Molecular mass",
"@value": [
172.014
],
"provenance": [
{
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"prov:hadPrimarySource": [
"C1=CC(=C(C=C1C#N)Cl)Cl"
]
},
{
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"prov:hadPrimarySource": [
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]
}
],
"attested_by": {
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},
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
},
"https://w3id.org/chemrof/monoisotopic_mass": {
"@id": "https://w3id.org/chemrof/monoisotopic_mass",
"rdfs:label": "Monoisotopic mass",
"@value": [
170.964254
],
"provenance": [
{
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]
},
{
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]
}
],
"attested_by": {
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]
},
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
}
},
"references": [
{
"@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J225.195G",
"provenance": {
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"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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],
"prov:wasDerivedFrom": "pubchem.identifiers[6574-99-8]"
}
},
{
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}
},
{
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"provenance": {
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],
"prov:wasDerivedFrom": "cas_numbers"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID90215944",
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}
},
{
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},
{
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"prov:wasDerivedFrom": "pubchem.by_cas[6574-99-8]"
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},
{
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}
],
"created_from": {
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"seed_uuid": "0ea672c2-bee6-4248-8cb8-97fbef59b255",
"seed_source": "EF 3.1",
"semantic_typing": {
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"reason": "",
"types": [
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],
"provenance": {
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}
}
},
"classifications": {
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"@value": [
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],
"rdfs:seeAlso": [
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],
"http://www.w3.org/2004/02/skos/core#exactMatch": [
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}
},
"origin_qualifier": null,
"parent_flow_object_id": null,
"parent_intervention_id": null,
"@type": [
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]
}
