Sec-butylbenzene
Everything that changed this flow. Back to the flow
fe0acd60-3ddc-11dd-abef-0050c2490048
By field
14 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 4 | enrich_references, normalise_property_values, opsin_iupac, rdkit_post_consensus | typed the way the ontology types it |
| altLabel | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 8466' (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=sec-butylbenzene||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'135-98-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-80dfc65f0f03ff96: {'135-98-8': '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 |
| ec_numbers | 1 | ec_cross_check | Resolved from EC-inventory: 205-227-0 from CAS 135-98-8 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['135-98-8']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_35097']; candidate_pubchem_cids=[8680, 14091, 10909617]; selected_pubchem_cids=[8680]; 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
20| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 3,379 | bootstrap_labels | prefLabel | — | [{"@value":"sec-butylbenzene","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Bootstrapped prefLabel from legacy name field |
| 3,380 | bootstrap_labels | name | sec-butylbenzene | — | Purged legacy name field to enforce prefLabel usage |
| 3,381 | bootstrap_labels | synonyms | ["(1-Methylpropyl)benzene","2-Phenylbutane","AC1L1RHS","AC1Q1HZF","AKOS000120879","B0714","Benzene, (1-methylpropyl)-",… | [] | Removed legacy synonyms field in favor of structured labels |
| 209,196 | 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 |
| 209,197 | 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 |
| 214,467 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,867 | normalize_name_case | prefLabel | [{"@value":"sec-butylbenzene","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | [{"@value":"Sec-butylbenzene","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 226,739 | ec_cross_check | ec_numbers | [] | ["205-227-0"] | Resolved from EC-inventory: 205-227-0 from CAS 135-98-8 |
| 230,435 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14"],"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 230,436 | enrich_references | skos_definition | — | [{"@value":"An alkylbenzene that is benzene substituted by a butan-2-yl group.","@language":"en","provenance":{"prov:wa… | Merged ChEBI/PubChem definitions into skos:definition |
| 230,437 | enrich_references | references | [] | [{"@id":"gmelin:261109","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"con… | Added references with provenance; cas_numbers=['135-98-8']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_35097']; candidate_pubchem_cids=[8680, 14091, 10909617]; selected_pubchem_cids=[8680]; 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 |
| 254,783 | chebi_altlabels | altLabel | [] | [{"@value":"(1-Methylpropyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttrib… | Added 4 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 271,581 | consensus_match | altLabel | [{"@value":"(1-Methylpropyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttrib… | [{"@value":"(1-Methylpropyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttrib… | group_key=sec-butylbenzene||dimension=Environmental > media=Ground > geography=Agricultural; cas=135-98-8; added Common Chemistry CAS names as altLabel: (<em>RS</em>)-2-Phenylbutane, (±)-<em>sec</em>-Butylbenzene, (α-Methylpropyl)benzene, Benzene, (1-methylpropyl)-, Benzene, <em>sec</em>-butyl-, NSC 8466; object_uuid=fo-80dfc65f0f03ff96 |
| 271,582 | consensus_match | cas_match_labels | — | {"135-98-8":"exactMatch"} | group_key=sec-butylbenzene||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'135-98-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-80dfc65f0f03ff96: {'135-98-8': 'exactMatch'} |
| 274,379 | 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 'Sec-butylbenzene' |
| 280,814 | 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 'CCC(C)c1ccccc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,933 | strip_catalogue_altlabels | altLabel | [{"@value":"(1-Methylpropyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttrib… | [{"@value":"(1-Methylpropyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttrib… | Removed 1 catalogue altLabel value(s): 'NSC 8466' (registry code) |
| 385,637 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/fe0acd60-3ddc-… | associations resolved on the elementary layer |
| 388,674 | 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 |
| 395,505 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
20 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/20260821T1554374006150000/3379 | prefLabel | ef:agent/bootstrap_labels | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v0 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v1 |
| ef:activity/change/20260821T1554374006150000/3380 | name | ef:agent/bootstrap_labels | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v1 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v2 |
| ef:activity/change/20260821T1554374006150000/3381 | synonyms | ef:agent/bootstrap_labels | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v2 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v3 |
| ef:activity/change/20260821T1554374006150000/209196 | context | ef:agent/default_context_mapping | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v3 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v4 |
| ef:activity/change/20260821T1554374006150000/209197 | context_iri | ef:agent/default_context_mapping | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v4 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v5 |
| ef:activity/change/20260821T1554374006150000/214467 | unit_iri | ef:agent/unit_normalization | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v5 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v6 |
| ef:activity/change/20260821T1554374006150000/221867 | prefLabel | ef:agent/normalize_name_case | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v6 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v7 |
| ef:activity/change/20260821T1554374006150000/226739 | ec_numbers | ef:agent/ec_cross_check | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v7 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v8 |
| ef:activity/change/20260821T1554374006150000/230435 | properties | ef:agent/enrich_references | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v8 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v9 |
| ef:activity/change/20260821T1554374006150000/230436 | skos_definition | ef:agent/enrich_references | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v9 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v10 |
| ef:activity/change/20260821T1554374006150000/230437 | references | ef:agent/enrich_references | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v10 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v11 |
| ef:activity/change/20260821T1554374006150000/254783 | altLabel | ef:agent/chebi_altlabels | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v11 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v12 |
| ef:activity/change/20260821T1554374006150000/271581 | altLabel | ef:agent/consensus_match | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v12 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v13 |
| ef:activity/change/20260821T1554374006150000/271582 | cas_match_labels | ef:agent/consensus_match | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v13 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v14 |
| ef:activity/change/20260821T1554374006150000/274379 | properties | ef:agent/opsin_iupac | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v14 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v15 |
| ef:activity/change/20260821T1554374006150000/280814 | properties | ef:agent/rdkit_post_consensus | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v15 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v16 |
| ef:activity/change/20260821T1554374006150000/287933 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v16 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v17 |
| ef:activity/change/20260821T1554374006150000/385637 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v17 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v18 |
| ef:activity/change/20260821T1554374006150000/388674 | properties | ef:agent/normalise_property_values | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v18 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v19 |
| ef:activity/change/20260821T1554374006150000/395505 | types | ef:agent/link_flows_to_their_substance | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v19 | ef:flow/fe0acd60-3ddc-11dd-abef-0050c2490048/v20 |