Flow object JSON
{
"flow_object_id": "fo-3dcf93be993ccd46",
"prefLabel": [
{
"@value": "3,3',4,4'-tetrachlorobiphenyl Ether",
"@language": "en",
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],
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}
}
],
"altLabel": [
{
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],
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}
},
{
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],
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}
},
{
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],
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}
},
{
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],
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}
},
{
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Benzene, 1,1′-oxybis[3,4-dichloro-",
"@language": "en",
"@lang": "en",
"provenance": {
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Benzene, 1,2-dichloro-4-(3,4-dichlorophenoxy)-",
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"provenance": {
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
}
],
"properties": {
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"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C12H6Cl4O"
],
"attested_by": {
"C12H6Cl4O": [
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"rdkit_post_consensus"
]
},
"rdfs:label": "Molecular formula",
"provenance": [
{
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},
{
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"prov:hadPrimarySource": [
"Clc1ccc(Oc2ccc(Cl)c(Cl)c2)cc1Cl"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"DHLVZXZRIZBPKG-UHFFFAOYSA-N"
],
"attested_by": {
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},
"rdfs:label": "InChIKey",
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{
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},
{
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]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"rdfs:label": "SMILES",
"@value": [
"Clc1ccc(Oc2ccc(Cl)c(Cl)c2)cc1Cl"
],
"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/C12H6Cl4O/c13-9-3-1-7(5-11(9)15)17-8-2-4-10(14)12(16)6-8/h1-6H"
],
"provenance": [
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},
{
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}
],
"attested_by": {
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}
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"rdfs:label": "IUPAC name",
"@value": [
"1,2-Dichloro-4-(3,4-dichlorophenoxy)benzene"
],
"provenance": {
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]
},
"attested_by": {
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}
},
"https://w3id.org/chemrof/molecular_mass": {
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"rdfs:label": "Molecular mass",
"@value": [
307.991
],
"provenance": [
{
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"prov:hadPrimarySource": [
"C1=CC(=C(C=C1OC2=CC(=C(C=C2)Cl)Cl)Cl)Cl"
]
},
{
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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": [
305.917276
],
"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=J151.749J",
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},
{
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},
{
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},
{
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{
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{
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],
"created_from": {
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},
"classifications": {
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],
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},
"origin_qualifier": null,
"parent_flow_object_id": null,
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"@type": [
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}