Consensus flow list

Identity

Substance
fo-d35fa4d9f57ee569 Neutral molecule
Source
EF 3.1
Unit
kg
Context
Environmental → Air → Unknown
CAS
939-99-1
EC

Context

Dimension
Environmental
Media
Air
Strata
Unknown

Source lists

1
List Version Source flow Name there Why this flow
EF 3.1 fe0acd60-3ddc-11dd-a089-0050c2490048 para-trifluoromethyl-chloro-benzene The consensus list is built from this one, so this row is the flow itself rather than something matched to it.

Concept associations

1
Source list Source flow Name there Compartment there Match Conversion
EF 3.1 fe0acd60-3ddc-11dd-a089-0050c2490048 para-trifluoromethyl-chloro-benzene Emissions/Emissions to air/Emissions to air, unspecified exactMatch

History

The change log and the PROV-O trail (1 consensus changes)

Open the changes page

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Full record

Flow JSON
{
  "altLabel": [],
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      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C7H4ClF3",
        "C8H6ClF3"
      ],
      "attested_by": {
        "C8H6ClF3": [
          "enrich_references.pubchem_semantic"
        ],
        "C7H4ClF3": [
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "Molecular formula",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:123096"
          ],
          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "FC(F)(F)c1ccc(Cl)cc1"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "MCHDHQVROPEJJT-UHFFFAOYSA-N",
        "QULYNCCPRWKEMF-UHFFFAOYSA-N"
      ],
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        ],
        "QULYNCCPRWKEMF-UHFFFAOYSA-N": [
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "InChIKey",
      "provenance": [
        {
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          "prov:wasDerivedFrom": "pubchem.props.InChIKey"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "FC(F)(F)c1ccc(Cl)cc1"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "FC(F)(F)c1ccc(Cl)cc1"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
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          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
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          ]
        }
      ],
      "attested_by": {
        "FC(F)(F)c1ccc(Cl)cc1": [
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        ]
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/C7H4ClF3/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4H"
      ],
      "provenance": [
        {
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          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
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          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
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          ]
        }
      ],
      "attested_by": {
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          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
        "Para-trifluoromethyl-chloro-benzene"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "opsin_iupac",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "Para-trifluoromethyl-chloro-benzene"
        ]
      },
      "attested_by": {
        "Para-trifluoromethyl-chloro-benzene": [
          "opsin_iupac"
        ]
      }
    }
  },
  "references": [
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J474.240K",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[939-99-1]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.155.872",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[939-99-1]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=939-99-1",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID20239870",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[939-99-1]"
      }
    },
    {
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      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
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        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[939-99-1]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q72511787",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[939-99-1]"
      }
    }
  ],
  "prefLabel": [
    {
      "@value": "Para-trifluoromethyl-chloro-benzene",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ],
  "http://www.w3.org/2004/02/skos/core#definition": [],
  "uuid": "fe0acd60-3ddc-11dd-a089-0050c2490048",
  "identifier": "fe0acd60-3ddc-11dd-a089-0050c2490048",
  "source": "EF 3.1",
  "cas_numbers": [
    "939-99-1"
  ],
  "ec_numbers": [],
  "context": {
    "dimension": "Environmental",
    "media": "Air",
    "strata": "Unknown"
  },
  "synonyms": [],
  "lcia_methods": [],
  "unit": "kg",
  "input_datasets": [
    "EF 3.1"
  ],
  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-air-unkn",
  "unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
  "flow_object_id": "fo-d35fa4d9f57ee569",
  "concept_associations": [
    {
      "@type": "xkos:ConceptAssociation",
      "xkos:sourceConcept": {
        "@id": "https://vocab.brightway.one/ef/3.1/flow/fe0acd60-3ddc-11dd-a089-0050c2490048",
        "skos:prefLabel": "para-trifluoromethyl-chloro-benzene",
        "context": "Emissions/Emissions to air/Emissions to air, unspecified",
        "qudt:hasUnit": {
          "@id": "https://vocab.brightway.one/units/unit/KiloGM"
        },
        "skos:exactMatch": {
          "@id": "https://vocab.brightway.dev/elementary-flows/fe0acd60-3ddc-11dd-a089-0050c2490048"
        }
      },
      "xkos:targetConcept": {
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      },
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ]
      }
    }
  ],
  "_sources": {
    "prefLabel": "normalize_name_case",
    "name": "bootstrap_labels",
    "synonyms": "bootstrap_labels",
    "context": "default_context_mapping",
    "context_iri": "default_context_mapping",
    "unit_iri": "unit_normalization",
    "properties": "withhold_ambiguous_mass",
    "skos_definition": "enrich_references",
    "references": "enrich_references",
    "cas_match_labels": "consensus_match",
    "concept_associations": "carry_associations_onto_flows",
    "types": "link_flows_to_their_substance"
  },
  "cas_match_labels": {
    "939-99-1": "exactMatch"
  },
  "_transformed": true,
  "_provided": {
    "name": "para-trifluoromethyl-chloro-benzene",
    "synonyms": [
      "1-(chloromethyl)-4-(trifluoromethyl)benzene",
      "4-(Chloromethyl)benzotrifluoride",
      "4-(Trifluoromethyl)benzyl chloride",
      "4-Trifluoromethylbenzyl chloride",
      "4-trifluoromethyl benzyl chloride",
      "AC1L3VUO",
      "AC1Q3U8R",
      "AC1Q4J3H",
      "AC1Q4J3I",
      "AKOS000118139",
      "ALBB-006036",
      "FT-0085054",
      "JRD-0775",
      "SBB006696",
      "alpha'-Chloro-alpha,alpha,alpha-trifluoro-p-xylene",
      "alpha-Chloro-alpha',alpha',alpha'-trifluoro-p-xylene",
      "g1r dxfff",
      "p-(trifluoromethyl)benzyl chloride",
      "p-Trifluoromethylbenzyl chloride"
    ],
    "context": [
      "Emissions",
      "Emissions to air",
      "Emissions to air, unspecified"
    ],
    "cas_numbers": [
      "939-99-1"
    ],
    "ec_numbers": [],
    "unit": "kg"
  }
}

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