4-tert-butylbenzaldehyde
Everything that changed this flow. Back to the flow
3d6b2103-06cf-44ea-823a-abac3b295b66
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=4-tert-butylbenzaldehyde||dimension=Environmental > media=Air > strata=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'939-97-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-d5b3e58a1a7a25de: {'939-97-9': '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 sea water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 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=['939-97-9']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_232598']; candidate_pubchem_cids=[70324, 83791]; selected_pubchem_cids=[70324]; 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 |
|---|---|---|---|---|---|
| 16,032 | bootstrap_labels | prefLabel | — | [{"@value":"4-tert-butylbenzaldehyde","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | Bootstrapped prefLabel from legacy name field |
| 16,033 | bootstrap_labels | name | 4-tert-butylbenzaldehyde | — | Purged legacy name field to enforce prefLabel usage |
| 16,034 | bootstrap_labels | synonyms | ["organic","4-tert-butylbenzaldehyde","4-(1,1-dimethylethyl)benzaldehyd","4-(1,1-dimethylethyl)benzaldehyde","4-tert.-b… | [] | Removed legacy synonyms field in favor of structured labels |
| 77,082 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Ocean"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 77,083 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-ocea | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 218,606 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 242,275 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14O"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 242,276 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 242,277 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J298.539J","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['939-97-9']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_232598']; candidate_pubchem_cids=[70324, 83791]; selected_pubchem_cids=[70324]; 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 |
| 252,670 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14O"],… | rdkit_pre_consensus from 'CC(C)(C)C1=CC=C(C=C1)C=O'; added: monoisotopic_mass |
| 262,929 | consensus_match | altLabel | [] | [{"@value":"4-(1,1-Dimethylethyl)benzaldehyde","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov… | group_key=4-tert-butylbenzaldehyde||dimension=Environmental > media=Air > strata=Unknown; cas=939-97-9; added Common Chemistry CAS names as altLabel: 4-(1,1-Dimethylethyl)benzaldehyde, <em>p</em>-<em>tert</em>-Butylbenzaldehyde, <em>para</em>-<em>tert</em>-Butylbenzaldehyde, Benzaldehyde, 4-(1,1-dimethylethyl)-, Benzaldehyde, <em>p</em>-<em>tert</em>-butyl-; object_uuid=fo-d5b3e58a1a7a25de |
| 262,930 | consensus_match | cas_match_labels | — | {"939-97-9":"exactMatch"} | group_key=4-tert-butylbenzaldehyde||dimension=Environmental > media=Air > strata=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'939-97-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-d5b3e58a1a7a25de: {'939-97-9': 'exactMatch'} |
| 277,876 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14O"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '4-tert-butylbenzaldehyde' |
| 284,586 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14O"],… | rdkit_post_consensus from 'CC(C)(C)c1ccc(C=O)cc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,858 | dedupe_altlabels | altLabel | [{"@value":"4-(1,1-Dimethylethyl)benzaldehyde","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov… | [{"@value":"4-(1,1-Dimethylethyl)benzaldehyde","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov… | Deduplicated altLabel values and removed entries matching prefLabel |
| 319,556 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/3d6b2103-06cf-… | associations resolved on the elementary layer |
| 392,232 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14O"],… | typed the way the ontology types it |
| 400,592 | 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/20260821T1554374006150000/16032 | prefLabel | ef:agent/bootstrap_labels | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v0 | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v1 |
| ef:activity/change/20260821T1554374006150000/16033 | name | ef:agent/bootstrap_labels | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v1 | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v2 |
| ef:activity/change/20260821T1554374006150000/16034 | synonyms | ef:agent/bootstrap_labels | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v2 | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v3 |
| ef:activity/change/20260821T1554374006150000/77082 | context | ef:agent/default_context_mapping | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v3 | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v4 |
| ef:activity/change/20260821T1554374006150000/77083 | context_iri | ef:agent/default_context_mapping | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v4 | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v5 |
| ef:activity/change/20260821T1554374006150000/218606 | unit_iri | ef:agent/unit_normalization | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v5 | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v6 |
| ef:activity/change/20260821T1554374006150000/242275 | properties | ef:agent/enrich_references | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v6 | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v7 |
| ef:activity/change/20260821T1554374006150000/242276 | skos_definition | ef:agent/enrich_references | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v7 | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v8 |
| ef:activity/change/20260821T1554374006150000/242277 | references | ef:agent/enrich_references | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v8 | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v9 |
| ef:activity/change/20260821T1554374006150000/252670 | properties | ef:agent/rdkit_pre_consensus | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v9 | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v10 |
| ef:activity/change/20260821T1554374006150000/262929 | altLabel | ef:agent/consensus_match | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v10 | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v11 |
| ef:activity/change/20260821T1554374006150000/262930 | cas_match_labels | ef:agent/consensus_match | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v11 | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v12 |
| ef:activity/change/20260821T1554374006150000/277876 | properties | ef:agent/opsin_iupac | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v12 | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v13 |
| ef:activity/change/20260821T1554374006150000/284586 | properties | ef:agent/rdkit_post_consensus | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v13 | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v14 |
| ef:activity/change/20260821T1554374006150000/292858 | altLabel | ef:agent/dedupe_altlabels | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v14 | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v15 |
| ef:activity/change/20260821T1554374006150000/319556 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v15 | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v16 |
| ef:activity/change/20260821T1554374006150000/392232 | properties | ef:agent/normalise_property_values | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v16 | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v17 |
| ef:activity/change/20260821T1554374006150000/400592 | types | ef:agent/link_flows_to_their_substance | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v17 | ef:flow/3d6b2103-06cf-44ea-823a-abac3b295b66/v18 |