3-(4-tert-butylphenyl)acrylaldehyde
Everything that changed this flow. Back to the flow
9feb2392-c81a-4e99-8d9c-e92544954f9a
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=3-(4-tert-butylphenyl)acrylaldehyde||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory']; cas_sources={'84434-23-1': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-6b247c00309e6594: {'84434-23-1': '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 water > Emissions to water, unspecified (long-term) |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 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=['84434-23-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[3019860, 6365958]; selected_pubchem_cids=[3019860]; 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 |
|---|---|---|---|---|---|
| 11,127 | bootstrap_labels | prefLabel | — | [{"@value":"3-(4-tert-butylphenyl)acrylaldehyde","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","p… | Bootstrapped prefLabel from legacy name field |
| 11,128 | bootstrap_labels | name | 3-(4-tert-butylphenyl)acrylaldehyde | — | Purged legacy name field to enforce prefLabel usage |
| 11,129 | bootstrap_labels | synonyms | ["organic","p-tert-butylcinnamaldehyde","dhbourgeonal"] | [] | Removed legacy synonyms field in favor of structured labels |
| 144,902 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 144,903 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 217,028 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 237,767 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H16O"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 237,768 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 237,769 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=84434-23-1","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['84434-23-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[3019860, 6365958]; selected_pubchem_cids=[3019860]; 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 |
| 251,358 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H16O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H16O"],… | rdkit_pre_consensus from 'CC(C)(C)C1=CC=C(C=C1)C=CC=O'; added: molecular_mass, monoisotopic_mass |
| 261,761 | consensus_match | altLabel | [] | [{"@value":"2-Propenal, 3-[4-(1,1-dimethylethyl)phenyl]-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_m… | group_key=3-(4-tert-butylphenyl)acrylaldehyde||dimension=Environmental > media=Air > strata=Unknown; cas=84434-23-1; added Common Chemistry CAS names as altLabel: 2-Propenal, 3-[4-(1,1-dimethylethyl)phenyl]-, 3-[4-(1,1-Dimethylethyl)phenyl]-2-propenal, 4-<em>tert</em>-Butylcinnamaldehyde, <em>p</em>-<em>tert</em>-Butylcinnamaldehyde, Cinnamaldehyde, <em>p</em>-<em>tert</em>-butyl-; object_uuid=fo-6b247c00309e6594 |
| 261,762 | consensus_match | cas_match_labels | — | {"84434-23-1":"exactMatch"} | group_key=3-(4-tert-butylphenyl)acrylaldehyde||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory']; cas_sources={'84434-23-1': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-6b247c00309e6594: {'84434-23-1': 'exactMatch'} |
| 276,538 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H16O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H16O"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '3-(4-tert-butylphenyl)acrylaldehyde' |
| 283,153 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H16O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H16O"],… | rdkit_post_consensus from 'CC(C)(C)c1ccc(C=CC=O)cc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,554 | dedupe_altlabels | altLabel | [{"@value":"2-Propenal, 3-[4-(1,1-dimethylethyl)phenyl]-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_m… | [{"@value":"2-Propenal, 3-[4-(1,1-dimethylethyl)phenyl]-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_m… | Deduplicated altLabel values and removed entries matching prefLabel |
| 353,453 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/9feb2392-c81a-… | associations resolved on the elementary layer |
| 390,895 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H16O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H16O"],… | typed the way the ontology types it |
| 398,701 | 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/20260821T1554374006150000/11127 | prefLabel | ef:agent/bootstrap_labels | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v0 | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v1 |
| ef:activity/change/20260821T1554374006150000/11128 | name | ef:agent/bootstrap_labels | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v1 | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v2 |
| ef:activity/change/20260821T1554374006150000/11129 | synonyms | ef:agent/bootstrap_labels | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v2 | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v3 |
| ef:activity/change/20260821T1554374006150000/144902 | context | ef:agent/default_context_mapping | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v3 | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v4 |
| ef:activity/change/20260821T1554374006150000/144903 | context_iri | ef:agent/default_context_mapping | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v4 | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v5 |
| ef:activity/change/20260821T1554374006150000/217028 | unit_iri | ef:agent/unit_normalization | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v5 | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v6 |
| ef:activity/change/20260821T1554374006150000/237767 | properties | ef:agent/enrich_references | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v6 | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v7 |
| ef:activity/change/20260821T1554374006150000/237768 | skos_definition | ef:agent/enrich_references | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v7 | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v8 |
| ef:activity/change/20260821T1554374006150000/237769 | references | ef:agent/enrich_references | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v8 | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v9 |
| ef:activity/change/20260821T1554374006150000/251358 | properties | ef:agent/rdkit_pre_consensus | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v9 | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v10 |
| ef:activity/change/20260821T1554374006150000/261761 | altLabel | ef:agent/consensus_match | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v10 | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v11 |
| ef:activity/change/20260821T1554374006150000/261762 | cas_match_labels | ef:agent/consensus_match | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v11 | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v12 |
| ef:activity/change/20260821T1554374006150000/276538 | properties | ef:agent/opsin_iupac | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v12 | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v13 |
| ef:activity/change/20260821T1554374006150000/283153 | properties | ef:agent/rdkit_post_consensus | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v13 | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v14 |
| ef:activity/change/20260821T1554374006150000/292554 | altLabel | ef:agent/dedupe_altlabels | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v14 | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v15 |
| ef:activity/change/20260821T1554374006150000/353453 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v15 | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v16 |
| ef:activity/change/20260821T1554374006150000/390895 | properties | ef:agent/normalise_property_values | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v16 | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v17 |
| ef:activity/change/20260821T1554374006150000/398701 | types | ef:agent/link_flows_to_their_substance | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v17 | ef:flow/9feb2392-c81a-4e99-8d9c-e92544954f9a/v18 |