Tert-butylbenzene
Everything that changed this flow. Back to the flow
5fef45c1-61c0-4bcd-93f3-ccce9ada03df
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 6557' (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=tert-butylbenzene||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'98-06-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-97cfe64433efb5df: {'98-06-6': '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 |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['98-06-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[7366, 9274, 18508]; selected_pubchem_cids=[7366]; 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 |
|---|---|---|---|---|---|
| 5,929 | bootstrap_labels | prefLabel | — | [{"@value":"tert-butylbenzene","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedT… | Bootstrapped prefLabel from legacy name field |
| 5,930 | bootstrap_labels | name | tert-butylbenzene | — | Purged legacy name field to enforce prefLabel usage |
| 5,931 | bootstrap_labels | synonyms | ["1,1-Dimethylethylbenzene","2-Methyl-2-phenylpropane","AC1L1OLJ","AC1Q1HYI","AKOS000120008","B0715","Benzene, (1,1-dim… | [] | Removed legacy synonyms field in favor of structured labels |
| 106,738 | 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 |
| 106,739 | 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 |
| 215,320 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,464 | normalize_name_case | prefLabel | [{"@value":"tert-butylbenzene","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedT… | [{"@value":"Tert-butylbenzene","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedT… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 232,882 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14"],"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 232,883 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 232,884 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J43.279B","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['98-06-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[7366, 9274, 18508]; selected_pubchem_cids=[7366]; 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 |
| 249,958 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14"],"… | rdkit_pre_consensus from 'CC(C)(C)C1=CC=CC=C1'; added: molecular_mass, monoisotopic_mass |
| 272,334 | consensus_match | altLabel | [] | [{"@value":"(1,1-Dimethylethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAtt… | group_key=tert-butylbenzene||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); cas=98-06-6; added Common Chemistry CAS names as altLabel: (1,1-Dimethylethyl)benzene, 2-Methyl-2-phenylpropane, <em>t</em>-Butylbenzene, Benzene, (1,1-dimethylethyl)-, Benzene, <em>tert</em>-butyl-, Dimethylethylbenzene, NSC 6557, Phenyltrimethylmethane, Trimethylphenylmethane; object_uuid=fo-97cfe64433efb5df |
| 272,335 | consensus_match | cas_match_labels | — | {"98-06-6":"exactMatch"} | group_key=tert-butylbenzene||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'98-06-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-97cfe64433efb5df: {'98-06-6': 'exactMatch'} |
| 275,092 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Tert-butylbenzene' |
| 281,587 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14"],"… | rdkit_post_consensus from 'CC(C)(C)c1ccccc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,464 | strip_catalogue_altlabels | altLabel | [{"@value":"(1,1-Dimethylethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAtt… | [{"@value":"(1,1-Dimethylethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAtt… | Removed 1 catalogue altLabel value(s): 'NSC 6557' (registry code) |
| 334,367 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/5fef45c1-61c0-… | associations resolved on the elementary layer |
| 389,400 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14"],"… | typed the way the ontology types it |
| 396,536 | 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/20260821T1554374006150000/5929 | prefLabel | ef:agent/bootstrap_labels | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v0 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v1 |
| ef:activity/change/20260821T1554374006150000/5930 | name | ef:agent/bootstrap_labels | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v1 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v2 |
| ef:activity/change/20260821T1554374006150000/5931 | synonyms | ef:agent/bootstrap_labels | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v2 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v3 |
| ef:activity/change/20260821T1554374006150000/106738 | context | ef:agent/default_context_mapping | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v3 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v4 |
| ef:activity/change/20260821T1554374006150000/106739 | context_iri | ef:agent/default_context_mapping | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v4 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v5 |
| ef:activity/change/20260821T1554374006150000/215320 | unit_iri | ef:agent/unit_normalization | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v5 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v6 |
| ef:activity/change/20260821T1554374006150000/222464 | prefLabel | ef:agent/normalize_name_case | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v6 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v7 |
| ef:activity/change/20260821T1554374006150000/232882 | properties | ef:agent/enrich_references | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v7 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v8 |
| ef:activity/change/20260821T1554374006150000/232883 | skos_definition | ef:agent/enrich_references | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v8 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v9 |
| ef:activity/change/20260821T1554374006150000/232884 | references | ef:agent/enrich_references | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v9 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v10 |
| ef:activity/change/20260821T1554374006150000/249958 | properties | ef:agent/rdkit_pre_consensus | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v10 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v11 |
| ef:activity/change/20260821T1554374006150000/272334 | altLabel | ef:agent/consensus_match | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v11 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v12 |
| ef:activity/change/20260821T1554374006150000/272335 | cas_match_labels | ef:agent/consensus_match | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v12 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v13 |
| ef:activity/change/20260821T1554374006150000/275092 | properties | ef:agent/opsin_iupac | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v13 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v14 |
| ef:activity/change/20260821T1554374006150000/281587 | properties | ef:agent/rdkit_post_consensus | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v14 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v15 |
| ef:activity/change/20260821T1554374006150000/288464 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v15 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v16 |
| ef:activity/change/20260821T1554374006150000/334367 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v16 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v17 |
| ef:activity/change/20260821T1554374006150000/389400 | properties | ef:agent/normalise_property_values | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v17 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v18 |
| ef:activity/change/20260821T1554374006150000/396536 | types | ef:agent/link_flows_to_their_substance | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v18 | ef:flow/5fef45c1-61c0-4bcd-93f3-ccce9ada03df/v19 |