1-bromooctane
Everything that changed this flow. Back to the flow
5cbb3ec9-058c-4724-81e3-9ce7c9235ae8
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 9821' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=1-bromooctane||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'111-83-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-08d7c69510a6ee5f: {'111-83-1': '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 (long-term) |
| 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 (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=['111-83-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[8140, 190562]; selected_pubchem_cids=[8140]; 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 |
|---|---|---|---|---|---|
| 17,302 | bootstrap_labels | prefLabel | — | [{"@value":"1-bromooctane","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"… | Bootstrapped prefLabel from legacy name field |
| 17,303 | bootstrap_labels | name | 1-bromooctane | — | Purged legacy name field to enforce prefLabel usage |
| 17,304 | bootstrap_labels | synonyms | ["1-BROMO-N-OCTANE","1-Bromo octane","1-Octylbromide","AB1002884","AC1L1QCT","AC1Q27V1","AC1Q2VWM","AKOS000119808","B06… | [] | Removed legacy synonyms field in favor of structured labels |
| 104,854 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 104,855 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 219,010 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 243,408 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H17Br"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 243,409 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 243,410 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.989E","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['111-83-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[8140, 190562]; selected_pubchem_cids=[8140]; 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 |
| 252,991 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H17Br"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H17Br"],… | rdkit_pre_consensus from 'CCCCCCCCBr'; added: molecular_mass, monoisotopic_mass |
| 259,013 | consensus_match | altLabel | [] | [{"@value":"1-Octylbromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"… | group_key=1-bromooctane||dimension=Environmental > media=Water > water_body=Long-term; cas=111-83-1; added Common Chemistry CAS names as altLabel: 1-Octylbromide, 8-Bromooctane, <em>n</em>-Octyl bromide, NSC 9821, Octane, 1-bromo-, Octyl bromide; object_uuid=fo-08d7c69510a6ee5f |
| 259,014 | consensus_match | cas_match_labels | — | {"111-83-1":"exactMatch"} | group_key=1-bromooctane||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'111-83-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-08d7c69510a6ee5f: {'111-83-1': 'exactMatch'} |
| 278,191 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H17Br"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H17Br"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1-bromooctane' |
| 284,931 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H17Br"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H17Br"],… | rdkit_post_consensus from 'CCCCCCCCBr'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,752 | strip_catalogue_altlabels | altLabel | [{"@value":"1-Octylbromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"… | [{"@value":"1-Octylbromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"… | Removed 1 catalogue altLabel value(s): 'NSC 9821' (registry code) |
| 333,417 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/5cbb3ec9-058c-… | associations resolved on the elementary layer |
| 392,538 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H17Br"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H17Br"],… | typed the way the ontology types it |
| 401,065 | 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/20260820T1812399309960000/17302 | prefLabel | ef:agent/bootstrap_labels | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v0 | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v1 |
| ef:activity/change/20260820T1812399309960000/17303 | name | ef:agent/bootstrap_labels | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v1 | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v2 |
| ef:activity/change/20260820T1812399309960000/17304 | synonyms | ef:agent/bootstrap_labels | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v2 | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v3 |
| ef:activity/change/20260820T1812399309960000/104854 | context | ef:agent/default_context_mapping | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v3 | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v4 |
| ef:activity/change/20260820T1812399309960000/104855 | context_iri | ef:agent/default_context_mapping | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v4 | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v5 |
| ef:activity/change/20260820T1812399309960000/219010 | unit_iri | ef:agent/unit_normalization | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v5 | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v6 |
| ef:activity/change/20260820T1812399309960000/243408 | properties | ef:agent/enrich_references | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v6 | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v7 |
| ef:activity/change/20260820T1812399309960000/243409 | skos_definition | ef:agent/enrich_references | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v7 | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v8 |
| ef:activity/change/20260820T1812399309960000/243410 | references | ef:agent/enrich_references | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v8 | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v9 |
| ef:activity/change/20260820T1812399309960000/252991 | properties | ef:agent/rdkit_pre_consensus | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v9 | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v10 |
| ef:activity/change/20260820T1812399309960000/259013 | altLabel | ef:agent/consensus_match | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v10 | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v11 |
| ef:activity/change/20260820T1812399309960000/259014 | cas_match_labels | ef:agent/consensus_match | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v11 | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v12 |
| ef:activity/change/20260820T1812399309960000/278191 | properties | ef:agent/opsin_iupac | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v12 | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v13 |
| ef:activity/change/20260820T1812399309960000/284931 | properties | ef:agent/rdkit_post_consensus | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v13 | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v14 |
| ef:activity/change/20260820T1812399309960000/290752 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v14 | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v15 |
| ef:activity/change/20260820T1812399309960000/333417 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v15 | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v16 |
| ef:activity/change/20260820T1812399309960000/392538 | properties | ef:agent/normalise_property_values | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v16 | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v17 |
| ef:activity/change/20260820T1812399309960000/401065 | types | ef:agent/link_flows_to_their_substance | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v17 | ef:flow/5cbb3ec9-058c-4724-81e3-9ce7c9235ae8/v18 |