2,6-diisopropylaniline
Everything that changed this flow. Back to the flow
7ea8149d-255a-451a-9035-86f8f2949997
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, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| cas_match_labels | 1 | consensus_match | group_key=2,6-diisopropylaniline||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'24544-04-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3031b2f50f9e0082: {'24544-04-5': '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=['24544-04-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[32484, 1201020]; selected_pubchem_cids=[32484]; 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
18| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 9,850 | bootstrap_labels | prefLabel | — | [{"@value":"2,6-diisopropylaniline","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttrib… | Bootstrapped prefLabel from legacy name field |
| 9,851 | bootstrap_labels | name | 2,6-diisopropylaniline | — | Purged legacy name field to enforce prefLabel usage |
| 9,852 | bootstrap_labels | synonyms | ["2,6-Diisopropyl aniline","2,6-Diisopropylphenylamine","2,6-Dilsopropylaniline","2,6-bis(1-methylethyl)aniline","2,6-d… | [] | Removed legacy synonyms field in favor of structured labels |
| 125,118 | 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 |
| 125,119 | 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 |
| 216,612 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 236,592 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H19N"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 236,593 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 236,594 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J33.769B","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['24544-04-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[32484, 1201020]; selected_pubchem_cids=[32484]; 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 |
| 251,025 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H19N"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H19N"],… | rdkit_pre_consensus from 'CC(C)C1=C(C(=CC=C1)C(C)C)N'; added: molecular_mass, monoisotopic_mass |
| 260,115 | consensus_match | altLabel | [] | [{"@value":"2,6-Bis(1-methylethyl)aniline","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | group_key=2,6-diisopropylaniline||dimension=Environmental > media=Water > water_body=Surface water; cas=24544-04-5; added Common Chemistry CAS names as altLabel: 2,6-Bis(1-methylethyl)aniline, 2,6-Bis(1-methylethyl)benzenamine, 2,6-Bis(propan-2-yl)aniline, 2,6-Di(propan-2-yl)aniline, 2,6-Diisopropylamine, 2,6-Diisopropylphenylamine, <em>N</em>-(2,6-Diisopropylphenyl)amine, Aniline, 2,6-diisopropyl-, Benzenamine, 2,6-bis(1-methylethyl)-; object_uuid=fo-3031b2f50f9e0082 |
| 260,116 | consensus_match | cas_match_labels | — | {"24544-04-5":"exactMatch"} | group_key=2,6-diisopropylaniline||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'24544-04-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3031b2f50f9e0082: {'24544-04-5': 'exactMatch'} |
| 276,211 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H19N"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H19N"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2,6-diisopropylaniline' |
| 282,794 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H19N"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H19N"],… | rdkit_post_consensus from 'CC(C)c1cccc(C(C)C)c1N'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,469 | dedupe_altlabels | altLabel | [{"@value":"2,6-Bis(1-methylethyl)aniline","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | [{"@value":"2,6-Bis(1-methylethyl)aniline","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | Deduplicated altLabel values and removed entries matching prefLabel |
| 343,561 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/7ea8149d-255a-… | associations resolved on the elementary layer |
| 390,556 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H19N"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H19N"],… | typed the way the ontology types it |
| 398,212 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
18 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/20260821T1554374006150000/9850 | prefLabel | ef:agent/bootstrap_labels | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v0 | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v1 |
| ef:activity/change/20260821T1554374006150000/9851 | name | ef:agent/bootstrap_labels | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v1 | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v2 |
| ef:activity/change/20260821T1554374006150000/9852 | synonyms | ef:agent/bootstrap_labels | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v2 | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v3 |
| ef:activity/change/20260821T1554374006150000/125118 | context | ef:agent/default_context_mapping | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v3 | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v4 |
| ef:activity/change/20260821T1554374006150000/125119 | context_iri | ef:agent/default_context_mapping | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v4 | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v5 |
| ef:activity/change/20260821T1554374006150000/216612 | unit_iri | ef:agent/unit_normalization | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v5 | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v6 |
| ef:activity/change/20260821T1554374006150000/236592 | properties | ef:agent/enrich_references | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v6 | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v7 |
| ef:activity/change/20260821T1554374006150000/236593 | skos_definition | ef:agent/enrich_references | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v7 | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v8 |
| ef:activity/change/20260821T1554374006150000/236594 | references | ef:agent/enrich_references | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v8 | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v9 |
| ef:activity/change/20260821T1554374006150000/251025 | properties | ef:agent/rdkit_pre_consensus | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v9 | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v10 |
| ef:activity/change/20260821T1554374006150000/260115 | altLabel | ef:agent/consensus_match | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v10 | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v11 |
| ef:activity/change/20260821T1554374006150000/260116 | cas_match_labels | ef:agent/consensus_match | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v11 | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v12 |
| ef:activity/change/20260821T1554374006150000/276211 | properties | ef:agent/opsin_iupac | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v12 | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v13 |
| ef:activity/change/20260821T1554374006150000/282794 | properties | ef:agent/rdkit_post_consensus | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v13 | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v14 |
| ef:activity/change/20260821T1554374006150000/292469 | altLabel | ef:agent/dedupe_altlabels | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v14 | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v15 |
| ef:activity/change/20260821T1554374006150000/343561 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v15 | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v16 |
| ef:activity/change/20260821T1554374006150000/390556 | properties | ef:agent/normalise_property_values | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v16 | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v17 |
| ef:activity/change/20260821T1554374006150000/398212 | types | ef:agent/link_flows_to_their_substance | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v17 | ef:flow/7ea8149d-255a-451a-9035-86f8f2949997/v18 |