Α,α,α-trifluoro-m-toluonitrile
Everything that changed this flow. Back to the flow
f2c977e4-3a7a-4241-8793-6a62ddd8305e
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 5 | enrich_references, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus | typed the way the ontology types it |
| altLabel | 2 | consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 88314' (registry code) |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| cas_match_labels | 1 | consensus_match | group_key=α,α,α-trifluoro-m-toluonitrile||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'368-77-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-1310d8f46dd9a42e: {'368-77-4': 'exactMatch'} |
| concept_associations | 1 | carry_associations_onto_flows | associations resolved on the elementary layer |
| context | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['368-77-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[67783, 10975945, 11737343]; selected_pubchem_cids=[67783]; formula_similarity_expected=[]; pubchem_selection_rule=curated_cas_then_formula_similarity_then_prefer_chebi_aligned_when_unambiguous_else_keep_all_cas_matches; single_cas_commonchem_link=yes |
| skos_definition | 1 | enrich_references | Merged ChEBI/PubChem definitions into skos:definition |
| synonyms | 1 | bootstrap_labels | Removed legacy synonyms field in favor of structured labels |
| types | 1 | link_flows_to_their_substance | the substance's answer, copied onto its flow |
| unit_iri | 1 | unit_normalization | Unit IRI set from normalization of 'kg' |
Where several steps wrote one field, the last one won — and the log below shows the sequence.
Changes
19| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 1,790 | bootstrap_labels | prefLabel | — | [{"@value":"α,α,α-trifluoro-m-toluonitrile","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:w… | Bootstrapped prefLabel from legacy name field |
| 1,791 | bootstrap_labels | name | α,α,α-trifluoro-m-toluonitrile | — | Purged legacy name field to enforce prefLabel usage |
| 1,792 | bootstrap_labels | synonyms | [".alpha.,.alpha.,.alpha.-Trifluoro-m-tolunitrile","3-(Trifluoromehyl)benzonitrile","3-(Trifluoromethyl)benzonitrile","… | [] | Removed legacy synonyms field in favor of structured labels |
| 195,816 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 195,817 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 213,935 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,509 | normalize_name_case | prefLabel | [{"@value":"α,α,α-trifluoro-m-toluonitrile","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:w… | [{"@value":"Α,α,α-trifluoro-m-toluonitrile","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:w… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 228,903 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H4F3N"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 228,904 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 228,905 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J208.236E","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['368-77-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[67783, 10975945, 11737343]; selected_pubchem_cids=[67783]; formula_similarity_expected=[]; pubchem_selection_rule=curated_cas_then_formula_similarity_then_prefer_chebi_aligned_when_unambiguous_else_keep_all_cas_matches; single_cas_commonchem_link=yes |
| 248,813 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H4F3N"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H4F3N"],… | rdkit_pre_consensus from 'C1=CC(=CC(=C1)C(F)(F)F)C#N'; added: molecular_mass, monoisotopic_mass |
| 273,393 | consensus_match | altLabel | [] | [{"@value":"1-Cyano-3-(trifluoromethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pro… | group_key=α,α,α-trifluoro-m-toluonitrile||dimension=Environmental > media=Ground > geography=Unknown; cas=368-77-4; added Common Chemistry CAS names as altLabel: 1-Cyano-3-(trifluoromethyl)benzene, 3-(Trifluoromethyl)benzonitrile, <em>m</em>-(Trifluoromethyl)benzonitrile, <em>m</em>-(Trifluoromethyl)cyanobenzene, <em>m</em>-Tolunitrile, α,α,α-trifluoro-, Benzonitrile, 3-(trifluoromethyl)-, NSC 88314, α,α,α-Trifluoro-<em>m</em>-tolunitrile; object_uuid=fo-1310d8f46dd9a42e |
| 273,394 | consensus_match | cas_match_labels | — | {"368-77-4":"exactMatch"} | group_key=α,α,α-trifluoro-m-toluonitrile||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'368-77-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-1310d8f46dd9a42e: {'368-77-4': 'exactMatch'} |
| 273,932 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H4F3N"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H4F3N"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1-Cyano-3-(trifluoromethyl)benzene' |
| 280,328 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H4F3N"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H4F3N"],… | rdkit_post_consensus from 'N#Cc1cccc(C(F)(F)F)c1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,605 | strip_catalogue_altlabels | altLabel | [{"@value":"1-Cyano-3-(trifluoromethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pro… | [{"@value":"1-Cyano-3-(trifluoromethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pro… | Removed 1 catalogue altLabel value(s): 'NSC 88314' (registry code) |
| 378,933 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/f2c977e4-3a7a-… | associations resolved on the elementary layer |
| 388,217 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H4F3N"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H4F3N"],… | typed the way the ontology types it |
| 394,858 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
19 activitiesOne activity per change: which version of the flow it consumed, and which it produced. The values are on the change with the same number — stored once, not twice.
| Activity | Field | Agent | Used | Generated |
|---|---|---|---|---|
| ef:activity/change/20260821T0609040591070000/1790 | prefLabel | ef:agent/bootstrap_labels | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v0 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v1 |
| ef:activity/change/20260821T0609040591070000/1791 | name | ef:agent/bootstrap_labels | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v1 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v2 |
| ef:activity/change/20260821T0609040591070000/1792 | synonyms | ef:agent/bootstrap_labels | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v2 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v3 |
| ef:activity/change/20260821T0609040591070000/195816 | context | ef:agent/default_context_mapping | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v3 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v4 |
| ef:activity/change/20260821T0609040591070000/195817 | context_iri | ef:agent/default_context_mapping | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v4 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v5 |
| ef:activity/change/20260821T0609040591070000/213935 | unit_iri | ef:agent/unit_normalization | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v5 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v6 |
| ef:activity/change/20260821T0609040591070000/221509 | prefLabel | ef:agent/normalize_name_case | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v6 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v7 |
| ef:activity/change/20260821T0609040591070000/228903 | properties | ef:agent/enrich_references | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v7 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v8 |
| ef:activity/change/20260821T0609040591070000/228904 | skos_definition | ef:agent/enrich_references | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v8 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v9 |
| ef:activity/change/20260821T0609040591070000/228905 | references | ef:agent/enrich_references | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v9 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v10 |
| ef:activity/change/20260821T0609040591070000/248813 | properties | ef:agent/rdkit_pre_consensus | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v10 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v11 |
| ef:activity/change/20260821T0609040591070000/273393 | altLabel | ef:agent/consensus_match | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v11 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v12 |
| ef:activity/change/20260821T0609040591070000/273394 | cas_match_labels | ef:agent/consensus_match | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v12 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v13 |
| ef:activity/change/20260821T0609040591070000/273932 | properties | ef:agent/opsin_iupac | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v13 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v14 |
| ef:activity/change/20260821T0609040591070000/280328 | properties | ef:agent/rdkit_post_consensus | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v14 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v15 |
| ef:activity/change/20260821T0609040591070000/287605 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v15 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v16 |
| ef:activity/change/20260821T0609040591070000/378933 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v16 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v17 |
| ef:activity/change/20260821T0609040591070000/388217 | properties | ef:agent/normalise_property_values | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v17 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v18 |
| ef:activity/change/20260821T0609040591070000/394858 | types | ef:agent/link_flows_to_their_substance | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v18 | ef:flow/f2c977e4-3a7a-4241-8793-6a62ddd8305e/v19 |