1-bromohexane
Everything that changed this flow. Back to the flow
f6264df1-eaeb-4c50-8e61-9481dece96da
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 71206' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=1-bromohexane||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'111-25-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7d246562832279cc: {'111-25-1': '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 air > Emissions to air, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 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=['111-25-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[8101, 54682830]; selected_pubchem_cids=[8101]; 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 |
|---|---|---|---|---|---|
| 6,088 | bootstrap_labels | prefLabel | — | [{"@value":"1-bromohexane","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"… | Bootstrapped prefLabel from legacy name field |
| 6,089 | bootstrap_labels | name | 1-bromohexane | — | Purged legacy name field to enforce prefLabel usage |
| 6,090 | bootstrap_labels | synonyms | ["1-Hexyl bromide","1-bromhexan","AB1002137","AC1L1Q9N","AC1Q27UL","AC1Q2VSA","AKOS000118767","B0600","BB_SC-6675","Bro… | [] | Removed legacy synonyms field in favor of structured labels |
| 197,712 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 197,713 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 215,374 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 233,035 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H13Br"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 233,036 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 233,037 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.986K","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['111-25-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[8101, 54682830]; selected_pubchem_cids=[8101]; 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 |
| 250,005 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H13Br"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H13Br"],… | rdkit_pre_consensus from 'CCCCCCBr'; added: molecular_mass, monoisotopic_mass |
| 259,009 | consensus_match | altLabel | [] | [{"@value":"1-Hexane bromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo"… | group_key=1-bromohexane||dimension=Environmental > media=Water > water_body=Unknown; cas=111-25-1; added Common Chemistry CAS names as altLabel: 1-Hexane bromide, 1-Hexylbromide, <em>n</em>-Hexyl bromide, Hexane, 1-bromo-, Hexyl bromide, NSC 71206; object_uuid=fo-7d246562832279cc |
| 259,010 | consensus_match | cas_match_labels | — | {"111-25-1":"exactMatch"} | group_key=1-bromohexane||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'111-25-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7d246562832279cc: {'111-25-1': 'exactMatch'} |
| 275,139 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H13Br"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H13Br"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1-bromohexane' |
| 281,631 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H13Br"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H13Br"],… | rdkit_post_consensus from 'CCCCCCBr'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,485 | strip_catalogue_altlabels | altLabel | [{"@value":"1-Hexane bromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo"… | [{"@value":"1-Hexane bromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo"… | Removed 1 catalogue altLabel value(s): 'NSC 71206' (registry code) |
| 379,883 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/f6264df1-eaeb-… | associations resolved on the elementary layer |
| 389,438 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H13Br"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H13Br"],… | typed the way the ontology types it |
| 396,593 | 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/20260820T1812399309960000/6088 | prefLabel | ef:agent/bootstrap_labels | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v0 | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v1 |
| ef:activity/change/20260820T1812399309960000/6089 | name | ef:agent/bootstrap_labels | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v1 | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v2 |
| ef:activity/change/20260820T1812399309960000/6090 | synonyms | ef:agent/bootstrap_labels | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v2 | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v3 |
| ef:activity/change/20260820T1812399309960000/197712 | context | ef:agent/default_context_mapping | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v3 | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v4 |
| ef:activity/change/20260820T1812399309960000/197713 | context_iri | ef:agent/default_context_mapping | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v4 | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v5 |
| ef:activity/change/20260820T1812399309960000/215374 | unit_iri | ef:agent/unit_normalization | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v5 | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v6 |
| ef:activity/change/20260820T1812399309960000/233035 | properties | ef:agent/enrich_references | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v6 | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v7 |
| ef:activity/change/20260820T1812399309960000/233036 | skos_definition | ef:agent/enrich_references | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v7 | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v8 |
| ef:activity/change/20260820T1812399309960000/233037 | references | ef:agent/enrich_references | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v8 | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v9 |
| ef:activity/change/20260820T1812399309960000/250005 | properties | ef:agent/rdkit_pre_consensus | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v9 | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v10 |
| ef:activity/change/20260820T1812399309960000/259009 | altLabel | ef:agent/consensus_match | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v10 | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v11 |
| ef:activity/change/20260820T1812399309960000/259010 | cas_match_labels | ef:agent/consensus_match | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v11 | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v12 |
| ef:activity/change/20260820T1812399309960000/275139 | properties | ef:agent/opsin_iupac | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v12 | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v13 |
| ef:activity/change/20260820T1812399309960000/281631 | properties | ef:agent/rdkit_post_consensus | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v13 | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v14 |
| ef:activity/change/20260820T1812399309960000/288485 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v14 | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v15 |
| ef:activity/change/20260820T1812399309960000/379883 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v15 | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v16 |
| ef:activity/change/20260820T1812399309960000/389438 | properties | ef:agent/normalise_property_values | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v16 | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v17 |
| ef:activity/change/20260820T1812399309960000/396593 | types | ef:agent/link_flows_to_their_substance | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v17 | ef:flow/f6264df1-eaeb-4c50-8e61-9481dece96da/v18 |