← Back to consensus flows

Phenyltin

2D structure
UUID cff46201-bfb0-486c-8f70-277a413c58a1
Flow Object IDfo-14a8f6178db4e5f7
Source ecoinvent-3.12
Context Environmental → Water → Ocean
CAS Numbers 2406-68-0
prefLabel
Language Value Provenance
en Phenyltin
References
Shared Properties
Predicate Value
InChIKey ODOPKAJVFRHHGM-UHFFFAOYSA-N
InChI InChI=1S/C6H5.Sn/c1-2-4-6-5-3-1;/h1-5H;
IUPAC name Phenyltin
Molecular formula C6H5Sn
Molecular mass 195.817
Monoisotopic mass 196.94132
SMILES [Sn].[c]1ccccc1

Source List References

List Version Source Flow UUID Source Flow Name
ecoinvent 3.12 cff46201-bfb0-486c-8f70-277a413c58a1 Phenyltin
ecoinvent 3.12 cff46201-bfb0-486c-8f70-277a413c58a1 Phenyltin

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
https://vocab.brightway.one/ecoinvent/3.12/flow/cff46201-bfb0-486c-8f70-277a413c58a1 Phenyltin water / ocean kg closeMatch

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
cas_match_labels 1 consensus_match group_key=phenyltin||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'2406-68-0': []}; assigned CAS labels from group consensus; object_uuid=fo-14a8f6178db4e5f7: {'2406-68-0': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyOcean

Consensus Changes

Field Old Value New Value Comment
cas_match_labels None {'2406-68-0': 'exactMatch'} group_key=phenyltin||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'2406-68-0': []}; assigned CAS labels from group consensus; object_uuid=fo-14a8f6178db4e5f7: {'2406-68-0': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
  "uuid": "cff46201-bfb0-486c-8f70-277a413c58a1",
  "name": null,
  "context": {
    "dimension": "Environmental",
    "media": "Water",
    "water_body": "Ocean"
  },
  "unit": "kg",
  "source": "ecoinvent-3.12",
  "cas_numbers": [
    "2406-68-0"
  ],
  "identifier": "cff46201-bfb0-486c-8f70-277a413c58a1",
  "ec_numbers": [],
  "synonyms": [],
  "lcia_methods": [],
  "input_datasets": [
    "ecoinvent-3.12"
  ],
  "source_refs": [
    {
      "list_name": "ecoinvent",
      "list_version": "3.12",
      "source_flow_uuid": "cff46201-bfb0-486c-8f70-277a413c58a1",
      "source_flow_name": "Phenyltin",
      "source_metadata": {
        "input_file": "/home/cmutel/.local/share/consensus-flow-list/additional-flow-input-ecoinvent-3.12-no-match.json",
        "input_dataset": "ecoinvent-3.12"
      }
    }
  ],
  "prefLabel": [
    {
      "@value": "Phenyltin",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "ecoinvent-3.12"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "_sources": {
    "prefLabel": "bootstrap_labels",
    "name": "bootstrap_labels",
    "context": "default_context_mapping",
    "context_iri": "default_context_mapping",
    "unit_iri": "unit_normalization",
    "skos:definition": "enrich_references",
    "references": "enrich_references",
    "cas_match_labels": "consensus_match",
    "properties": "rdkit_post_consensus"
  },
  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-wate-ocea",
  "unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
  "skos:definition": [],
  "references": [
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=2406-68-0",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "2406-68-0"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    }
  ],
  "cas_match_labels": {
    "2406-68-0": "exactMatch"
  },
  "properties": {
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
        "Phenyltin"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "opsin_iupac",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "Phenyltin"
        ]
      }
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "[Sn].[c]1ccccc1"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_authoritative",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "InChI=1S/C6H5.Sn/c1-2-4-6-5-3-1;/h1-5H;"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[Sn].[c]1ccccc1"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/C6H5.Sn/c1-2-4-6-5-3-1;/h1-5H;"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_authoritative",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "InChI=1S/C6H5.Sn/c1-2-4-6-5-3-1;/h1-5H;"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[Sn].[c]1ccccc1"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "rdfs:label": "InChIKey",
      "@value": [
        "ODOPKAJVFRHHGM-UHFFFAOYSA-N"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_authoritative",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "InChI=1S/C6H5.Sn/c1-2-4-6-5-3-1;/h1-5H;"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[Sn].[c]1ccccc1"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "rdfs:label": "Molecular formula",
      "@value": [
        "C6H5Sn"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_authoritative",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "InChI=1S/C6H5.Sn/c1-2-4-6-5-3-1;/h1-5H;"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[Sn].[c]1ccccc1"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "rdfs:label": "Molecular mass",
      "@value": [
        "195.817"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_authoritative",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "InChI=1S/C6H5.Sn/c1-2-4-6-5-3-1;/h1-5H;"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[Sn].[c]1ccccc1"
          ]
        }
      ],
      "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": [
        "196.94132"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_authoritative",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "InChI=1S/C6H5.Sn/c1-2-4-6-5-3-1;/h1-5H;"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[Sn].[c]1ccccc1"
          ]
        }
      ],
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    }
  },
  "flow_object_id": "fo-14a8f6178db4e5f7",
  "concept_associations": [
    {
      "@type": "xkos:ConceptAssociation",
      "xkos:sourceConcept": {
        "@id": "https://vocab.brightway.one/ecoinvent/3.12/flow/cff46201-bfb0-486c-8f70-277a413c58a1",
        "skos:prefLabel": "Phenyltin",
        "context": "water / ocean",
        "qudt:unit": "kg"
      },
      "xkos:targetConcept": {
        "@id": "https://vocab.brightway.dev/elementary-flows/cff46201-bfb0-486c-8f70-277a413c58a1"
      },
      "xkos:mapType": {
        "@id": "http://www.w3.org/2004/02/skos/core#closeMatch"
      },
      "provenance": {
        "prov:wasGeneratedBy": "merge_ecoinvent",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "ecoinvent:3.12:cff46201-bfb0-486c-8f70-277a413c58a1",
          "Phenyltin",
          "ecoinvent-3.11-biosphere-EF-3.1-biosphere",
          "algorithm.lookup_order=cas>ec>label",
          "algorithm.basis=cas:2406-68-0",
          "algorithm.flow_object_candidates=1",
          "algorithm.elementary_candidates=1",
          "algorithm.selector_reason=exact-context-iri-match",
          "algorithm.score_rule=exact-iri-shortcircuit;up-tree-filter;score=(2*unit_exact)+context_overlap-context_penalty"
        ],
        "prov:wasDerivedFrom": "algorithmic_fallback:lookup_order(cas>ec>label);basis(cas:2406-68-0);flow_object_candidates(1);elementary_candidates(1);selector(exact-context-iri-match);exact-iri-shortcircuit;up-tree-filter;score=(2*unit_exact)+context_overlap-context_penalty"
      }
    }
  ]
}