1-(2-ethylbutyl)cyclohexanecarbonitrile
Everything that changed this flow. Back to the flow
2daf1901-d56a-4000-a961-371b2cd5098e
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 | 1 | consensus_match | group_key=1-(2-ethylbutyl)cyclohexanecarbonitrile||dimension=Environmental > media=Air > indoor=Unknown; cas=855425-38-6; added Common Chemistry CAS names as altLabel: Cyclohexanecarbonitrile, 1-(2-ethylbutyl)-; object_uuid=fo-b9c50ad2c8e32495 |
| cas_match_labels | 1 | consensus_match | group_key=1-(2-ethylbutyl)cyclohexanecarbonitrile||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['pubchem']; cas_sources={'855425-38-6': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b9c50ad2c8e32495: {'855425-38-6': '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 urban air close to ground |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['855425-38-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[44242684]; selected_pubchem_cids=[44242684]; 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
17| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 18,773 | bootstrap_labels | prefLabel | — | [{"@value":"1-(2-ethylbutyl)cyclohexanecarbonitrile","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels… | Bootstrapped prefLabel from legacy name field |
| 18,774 | bootstrap_labels | name | 1-(2-ethylbutyl)cyclohexanecarbonitrile | — | Purged legacy name field to enforce prefLabel usage |
| 18,775 | bootstrap_labels | synonyms | ["organic"] | [] | Removed legacy synonyms field in favor of structured labels |
| 67,152 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Ground level","population_density":"Urban (>1000 people/square mil… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 67,153 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 219,467 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 244,686 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H23N"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 244,687 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 244,688 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.117.006","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['855425-38-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[44242684]; selected_pubchem_cids=[44242684]; 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 |
| 253,363 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H23N"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H23N"],… | rdkit_pre_consensus from 'CCC(CC)CC1(CCCCC1)C#N'; added: molecular_mass, monoisotopic_mass |
| 258,812 | consensus_match | altLabel | [] | [{"@value":"Cyclohexanecarbonitrile, 1-(2-ethylbutyl)-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_mat… | group_key=1-(2-ethylbutyl)cyclohexanecarbonitrile||dimension=Environmental > media=Air > indoor=Unknown; cas=855425-38-6; added Common Chemistry CAS names as altLabel: Cyclohexanecarbonitrile, 1-(2-ethylbutyl)-; object_uuid=fo-b9c50ad2c8e32495 |
| 258,813 | consensus_match | cas_match_labels | — | {"855425-38-6":"exactMatch"} | group_key=1-(2-ethylbutyl)cyclohexanecarbonitrile||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['pubchem']; cas_sources={'855425-38-6': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b9c50ad2c8e32495: {'855425-38-6': 'exactMatch'} |
| 278,570 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H23N"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H23N"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1-(2-ethylbutyl)cyclohexanecarbonitrile' |
| 285,341 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H23N"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H23N"],… | rdkit_post_consensus from 'CCC(CC)CC1(C#N)CCCCC1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 314,586 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/2daf1901-d56a-… | associations resolved on the elementary layer |
| 392,931 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H23N"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H23N"],… | typed the way the ontology types it |
| 401,641 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
17 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/20260820T1812399309960000/18773 | prefLabel | ef:agent/bootstrap_labels | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v0 | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v1 |
| ef:activity/change/20260820T1812399309960000/18774 | name | ef:agent/bootstrap_labels | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v1 | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v2 |
| ef:activity/change/20260820T1812399309960000/18775 | synonyms | ef:agent/bootstrap_labels | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v2 | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v3 |
| ef:activity/change/20260820T1812399309960000/67152 | context | ef:agent/default_context_mapping | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v3 | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v4 |
| ef:activity/change/20260820T1812399309960000/67153 | context_iri | ef:agent/default_context_mapping | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v4 | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v5 |
| ef:activity/change/20260820T1812399309960000/219467 | unit_iri | ef:agent/unit_normalization | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v5 | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v6 |
| ef:activity/change/20260820T1812399309960000/244686 | properties | ef:agent/enrich_references | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v6 | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v7 |
| ef:activity/change/20260820T1812399309960000/244687 | skos_definition | ef:agent/enrich_references | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v7 | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v8 |
| ef:activity/change/20260820T1812399309960000/244688 | references | ef:agent/enrich_references | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v8 | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v9 |
| ef:activity/change/20260820T1812399309960000/253363 | properties | ef:agent/rdkit_pre_consensus | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v9 | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v10 |
| ef:activity/change/20260820T1812399309960000/258812 | altLabel | ef:agent/consensus_match | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v10 | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v11 |
| ef:activity/change/20260820T1812399309960000/258813 | cas_match_labels | ef:agent/consensus_match | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v11 | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v12 |
| ef:activity/change/20260820T1812399309960000/278570 | properties | ef:agent/opsin_iupac | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v12 | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v13 |
| ef:activity/change/20260820T1812399309960000/285341 | properties | ef:agent/rdkit_post_consensus | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v13 | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v14 |
| ef:activity/change/20260820T1812399309960000/314586 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v14 | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v15 |
| ef:activity/change/20260820T1812399309960000/392931 | properties | ef:agent/normalise_property_values | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v15 | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v16 |
| ef:activity/change/20260820T1812399309960000/401641 | types | ef:agent/link_flows_to_their_substance | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v16 | ef:flow/2daf1901-d56a-4000-a961-371b2cd5098e/v17 |