3,3-dimethylbut-1-yne
Everything that changed this flow. Back to the flow
7d162755-90e4-48db-9669-c5e9cb526513
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, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| cas_match_labels | 1 | consensus_match | group_key=3,3-dimethylbut-1-yne||dimension=Environmental > media=Air > strata=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'917-92-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-2a764b3fcf342b1f: {'917-92-0': '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, indoor |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 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=['917-92-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[13512]; selected_pubchem_cids=[13512]; 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 |
|---|---|---|---|---|---|
| 4,344 | bootstrap_labels | prefLabel | — | [{"@value":"3,3-dimethylbut-1-yne","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribu… | Bootstrapped prefLabel from legacy name field |
| 4,345 | bootstrap_labels | name | 3,3-dimethylbut-1-yne | — | Purged legacy name field to enforce prefLabel usage |
| 4,346 | bootstrap_labels | synonyms | ["organic","3,3-dimethylbutyne"] | [] | Removed legacy synonyms field in favor of structured labels |
| 124,250 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","indoor":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 124,251 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-indr-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 214,790 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 231,358 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10"],"a… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 231,359 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 231,360 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J132.792E","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['917-92-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[13512]; selected_pubchem_cids=[13512]; 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 |
| 249,520 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10"],"a… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10"],"a… | rdkit_pre_consensus from 'CC(C)(C)C#C'; added: molecular_mass, monoisotopic_mass |
| 261,492 | consensus_match | altLabel | [] | [{"@value":"1-Butyne, 3,3-dimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttrib… | group_key=3,3-dimethylbut-1-yne||dimension=Environmental > media=Air > strata=Long-term; cas=917-92-0; added Common Chemistry CAS names as altLabel: 1-Butyne, 3,3-dimethyl-, 2,2-Dimethyl-3-butyne, 3,3,3-Trimethylpropyne, 3,3-Dimethyl-1-butyne, 3,3-Dimethylbutyne, <em>tert</em>-Butylacetylene, <em>tert</em>-Butylethyne, Neohexyne; object_uuid=fo-2a764b3fcf342b1f |
| 261,493 | consensus_match | cas_match_labels | — | {"917-92-0":"exactMatch"} | group_key=3,3-dimethylbut-1-yne||dimension=Environmental > media=Air > strata=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'917-92-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-2a764b3fcf342b1f: {'917-92-0': 'exactMatch'} |
| 274,651 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10"],"a… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10"],"a… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '3,3-dimethylbut-1-yne' |
| 281,107 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10"],"a… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10"],"a… | rdkit_post_consensus from 'C#CC(C)(C)C'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,198 | dedupe_altlabels | altLabel | [{"@value":"1-Butyne, 3,3-dimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttrib… | [{"@value":"1-Butyne, 3,3-dimethyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttrib… | Deduplicated altLabel values and removed entries matching prefLabel |
| 343,127 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/7d162755-90e4-… | associations resolved on the elementary layer |
| 388,956 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10"],"a… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10"],"a… | typed the way the ontology types it |
| 395,909 | 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/20260821T1554374006150000/4344 | prefLabel | ef:agent/bootstrap_labels | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v0 | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v1 |
| ef:activity/change/20260821T1554374006150000/4345 | name | ef:agent/bootstrap_labels | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v1 | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v2 |
| ef:activity/change/20260821T1554374006150000/4346 | synonyms | ef:agent/bootstrap_labels | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v2 | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v3 |
| ef:activity/change/20260821T1554374006150000/124250 | context | ef:agent/default_context_mapping | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v3 | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v4 |
| ef:activity/change/20260821T1554374006150000/124251 | context_iri | ef:agent/default_context_mapping | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v4 | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v5 |
| ef:activity/change/20260821T1554374006150000/214790 | unit_iri | ef:agent/unit_normalization | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v5 | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v6 |
| ef:activity/change/20260821T1554374006150000/231358 | properties | ef:agent/enrich_references | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v6 | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v7 |
| ef:activity/change/20260821T1554374006150000/231359 | skos_definition | ef:agent/enrich_references | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v7 | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v8 |
| ef:activity/change/20260821T1554374006150000/231360 | references | ef:agent/enrich_references | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v8 | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v9 |
| ef:activity/change/20260821T1554374006150000/249520 | properties | ef:agent/rdkit_pre_consensus | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v9 | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v10 |
| ef:activity/change/20260821T1554374006150000/261492 | altLabel | ef:agent/consensus_match | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v10 | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v11 |
| ef:activity/change/20260821T1554374006150000/261493 | cas_match_labels | ef:agent/consensus_match | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v11 | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v12 |
| ef:activity/change/20260821T1554374006150000/274651 | properties | ef:agent/opsin_iupac | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v12 | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v13 |
| ef:activity/change/20260821T1554374006150000/281107 | properties | ef:agent/rdkit_post_consensus | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v13 | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v14 |
| ef:activity/change/20260821T1554374006150000/292198 | altLabel | ef:agent/dedupe_altlabels | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v14 | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v15 |
| ef:activity/change/20260821T1554374006150000/343127 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v15 | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v16 |
| ef:activity/change/20260821T1554374006150000/388956 | properties | ef:agent/normalise_property_values | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v16 | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v17 |
| ef:activity/change/20260821T1554374006150000/395909 | types | ef:agent/link_flows_to_their_substance | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v17 | ef:flow/7d162755-90e4-48db-9669-c5e9cb526513/v18 |