2,2'-dioxybis(2-methylbutane)
Everything that changed this flow. Back to the flow
12f01bcf-954d-4bb8-892f-8584d9159b82
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): 'Trigonox 201' (trade name) |
| cas_match_labels | 1 | consensus_match | group_key=2,2'-dioxybis(2-methylbutane)||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'10508-09-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0cc78ce75469a30c: {'10508-09-5': '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 soil > Emissions to agricultural soil |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 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=['10508-09-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[25320, 76962]; selected_pubchem_cids=[25320]; 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 |
|---|---|---|---|---|---|
| 13,903 | bootstrap_labels | prefLabel | — | [{"@value":"2,2'-dioxybis(2-methylbutane)","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wa… | Bootstrapped prefLabel from legacy name field |
| 13,904 | bootstrap_labels | name | 2,2'-dioxybis(2-methylbutane) | — | Purged legacy name field to enforce prefLabel usage |
| 13,905 | bootstrap_labels | synonyms | ["organic","di-tert-pentylperoxide"] | [] | Removed legacy synonyms field in favor of structured labels |
| 48,552 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 48,553 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-agri | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 217,932 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 240,349 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H22O2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 240,350 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 240,351 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J116.170I","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['10508-09-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[25320, 76962]; selected_pubchem_cids=[25320]; 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 |
| 252,106 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H22O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H22O2"]… | rdkit_pre_consensus from 'CCC(C)(C)OOC(C)(C)CC'; added: molecular_mass, monoisotopic_mass |
| 259,487 | consensus_match | altLabel | [] | [{"@value":"<em>tert</em>-Amyl peroxide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAt… | group_key=2,2'-dioxybis(2-methylbutane)||dimension=Environmental > media=Ground > geography=Agricultural; cas=10508-09-5; added Common Chemistry CAS names as altLabel: <em>tert</em>-Amyl peroxide, <em>tert</em>-Pentyl peroxide, Bis(1,1-dimethylpropyl) peroxide, Di-<em>t</em>-amyl peroxide, Di-<em>tert</em>-amyl peroxide, Di-<em>tert</em>-pentyl peroxide, Luperox DTA, Peroxide, bis(1,1-dimethylpropyl), Peroximon S 172, Trigonox 201; object_uuid=fo-0cc78ce75469a30c |
| 259,488 | consensus_match | cas_match_labels | — | {"10508-09-5":"exactMatch"} | group_key=2,2'-dioxybis(2-methylbutane)||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'10508-09-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-0cc78ce75469a30c: {'10508-09-5': 'exactMatch'} |
| 277,298 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H22O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H22O2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2,2'-dioxybis(2-methylbutane)' |
| 283,969 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H22O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H22O2"]… | rdkit_post_consensus from 'CCC(C)(C)OOC(C)(C)CC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,099 | strip_catalogue_altlabels | altLabel | [{"@value":"<em>tert</em>-Amyl peroxide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAt… | [{"@value":"tert-Amyl peroxide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedT… | Removed 1 catalogue altLabel value(s): 'Trigonox 201' (trade name) |
| 305,296 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/12f01bcf-954d-… | associations resolved on the elementary layer |
| 391,647 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H22O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H22O2"]… | typed the way the ontology types it |
| 399,776 | 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/20260821T0609040591070000/13903 | prefLabel | ef:agent/bootstrap_labels | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v0 | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v1 |
| ef:activity/change/20260821T0609040591070000/13904 | name | ef:agent/bootstrap_labels | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v1 | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v2 |
| ef:activity/change/20260821T0609040591070000/13905 | synonyms | ef:agent/bootstrap_labels | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v2 | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v3 |
| ef:activity/change/20260821T0609040591070000/48552 | context | ef:agent/default_context_mapping | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v3 | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v4 |
| ef:activity/change/20260821T0609040591070000/48553 | context_iri | ef:agent/default_context_mapping | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v4 | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v5 |
| ef:activity/change/20260821T0609040591070000/217932 | unit_iri | ef:agent/unit_normalization | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v5 | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v6 |
| ef:activity/change/20260821T0609040591070000/240349 | properties | ef:agent/enrich_references | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v6 | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v7 |
| ef:activity/change/20260821T0609040591070000/240350 | skos_definition | ef:agent/enrich_references | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v7 | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v8 |
| ef:activity/change/20260821T0609040591070000/240351 | references | ef:agent/enrich_references | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v8 | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v9 |
| ef:activity/change/20260821T0609040591070000/252106 | properties | ef:agent/rdkit_pre_consensus | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v9 | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v10 |
| ef:activity/change/20260821T0609040591070000/259487 | altLabel | ef:agent/consensus_match | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v10 | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v11 |
| ef:activity/change/20260821T0609040591070000/259488 | cas_match_labels | ef:agent/consensus_match | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v11 | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v12 |
| ef:activity/change/20260821T0609040591070000/277298 | properties | ef:agent/opsin_iupac | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v12 | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v13 |
| ef:activity/change/20260821T0609040591070000/283969 | properties | ef:agent/rdkit_post_consensus | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v13 | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v14 |
| ef:activity/change/20260821T0609040591070000/290099 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v14 | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v15 |
| ef:activity/change/20260821T0609040591070000/305296 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v15 | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v16 |
| ef:activity/change/20260821T0609040591070000/391647 | properties | ef:agent/normalise_property_values | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v16 | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v17 |
| ef:activity/change/20260821T0609040591070000/399776 | types | ef:agent/link_flows_to_their_substance | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v17 | ef:flow/12f01bcf-954d-4bb8-892f-8584d9159b82/v18 |