Flow object JSON
{
"flow_object_id": "fo-e3d9a32549db1fd9",
"prefLabel": [
{
"@value": "Hexafluoroisopropyl Methyl Ether",
"@language": "en",
"@lang": "en",
"provenance": {
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"EF 3.1"
],
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}
}
],
"altLabel": [
{
"@value": "1,1,1,3,3,3-Hexafluoro-2-methoxypropane",
"@language": "en",
"@lang": "en",
"provenance": {
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"CAS:13171-18-1",
"EF 3.1",
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "1,1,1,3,3,3-Hexafluoroisopropyl methyl ether",
"@language": "en",
"@lang": "en",
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],
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}
},
{
"@value": "1-(Trifluoromethyl)-2,2,2-trifluoroethyl methyl ether",
"@language": "en",
"@lang": "en",
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"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=13171-18-1"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "1-Methoxy-1-trifluoromethyl-2,2,2-trifluoroethane",
"@language": "en",
"@lang": "en",
"provenance": {
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"https://commonchemistry.cas.org/detail?cas_rn=13171-18-1"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "356mmzEβγ",
"@language": "en",
"@lang": "en",
"provenance": {
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"prov:wasAttributedTo": "consensus-flow-list",
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"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=13171-18-1"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Bis(trifluoromethyl)methyl methyl ether",
"@language": "en",
"@lang": "en",
"provenance": {
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"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=13171-18-1"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Ether, methyl 2,2,2-trifluoro-1-(trifluoromethyl)ethyl",
"@language": "en",
"@lang": "en",
"provenance": {
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"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=13171-18-1"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "HFE 356mmz",
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"@lang": "en",
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"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=13171-18-1"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "HFE-356mmz1",
"@language": "en",
"@lang": "en",
"provenance": {
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],
"prov:wasDerivedFrom": "name the fix replaced, retained as altLabel"
}
},
{
"@value": "Iso-flurothyl",
"@language": "en",
"@lang": "en",
"provenance": {
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"prov:wasAttributedTo": "consensus-flow-list",
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"https://commonchemistry.cas.org/detail?cas_rn=13171-18-1"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Isoindoklon",
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"@lang": "en",
"provenance": {
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Methyl 1-(trifluoromethyl)-2,2,2-trifluoroethyl ether",
"@language": "en",
"@lang": "en",
"provenance": {
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Propane, 1,1,1,3,3,3-hexafluoro-2-methoxy-",
"@language": "en",
"@lang": "en",
"provenance": {
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
}
],
"properties": {
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"@id": "https://w3id.org/chemrof/IUPAC_name",
"rdfs:label": "IUPAC name",
"@value": [
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],
"provenance": {
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"prov:hadPrimarySource": [
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]
},
"attested_by": {
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]
}
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"rdfs:label": "SMILES",
"@value": [
"COC(C(F)(F)F)C(F)(F)F"
],
"provenance": [
{
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]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
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"prov:hadPrimarySource": [
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]
}
],
"attested_by": {
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}
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"rdfs:label": "InChI",
"@value": [
"InChI=1S/C4H4F6O/c1-11-2(3(5,6)7)4(8,9)10/h2H,1H3"
],
"provenance": [
{
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]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
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]
}
],
"attested_by": {
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}
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"rdfs:label": "InChIKey",
"@value": [
"VNXYDFNVQBICRO-UHFFFAOYSA-N"
],
"provenance": {
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]
},
"attested_by": {
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]
}
},
"https://w3id.org/chemrof/molecular_formula": {
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"rdfs:label": "Molecular formula",
"@value": [
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],
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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": [
182.063
],
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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": {
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"rdfs:label": "Monoisotopic mass",
"@value": [
182.016634
],
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},
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},
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
}
},
"references": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=13171-18-1",
"provenance": {
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}
}
],
"created_from": {
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"seed_uuid": "9ae3cafe-e251-11e6-bf01-fe55135034f3",
"seed_source": "EF 3.1",
"semantic_typing": {
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"reason": "",
"types": [
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],
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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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],
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}
},
"origin_qualifier": null,
"parent_flow_object_id": null,
"parent_intervention_id": null,
"@type": [
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]
}
