1,1,3,3-tetramethylbutyl 2-(ethylperoxy)hexanoate
Everything that changed this substance, across every flow that resolves to it. Back to the substance
fo-a74536ca1265953a
Changes
54| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 9,621 | bootstrap_labels | prefLabel | — | [{"@value":"1,1,3,3-tetramethylbutyl 2-(ethylperoxy)hexanoate","@language":"en","source":{"prov:wasGeneratedBy":"bootst… | Bootstrapped prefLabel from legacy name field |
| 9,622 | bootstrap_labels | name | 1,1,3,3-tetramethylbutyl 2-(ethylperoxy)hexanoate | — | Purged legacy name field to enforce prefLabel usage |
| 9,623 | bootstrap_labels | synonyms | ["organic","1,1,3,3-tetramethylbutyl2-ethylperoxyhexanoate","trigonox421"] | [] | Removed legacy synonyms field in favor of structured labels |
| 42,219 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Aircraft cruise height"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 42,220 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-aicrhe | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 42,825 | 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) |
| 42,826 | 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) |
| 45,647 | 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 |
| 45,648 | 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 |
| 60,187 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 60,188 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 120,021 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 120,022 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 123,023 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 123,024 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 123,993 | 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 |
| 123,994 | 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 |
| 132,861 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Surface water"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 132,862 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-suwa | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 156,137 | 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 |
| 156,138 | 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 |
| 168,419 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Non-agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 168,420 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-noag | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 175,407 | 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 |
| 175,408 | 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 |
| 188,107 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Ocean"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 188,108 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-ocea | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 199,585 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Medium stack, <150 meters","population_density":"Rural (<1000 peop… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 199,586 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-mest15me-ru10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 216,539 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 236,378 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H32O3"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 236,379 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 236,380 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.317J","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['22288-43-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[90761, 268249, 53421419]; selected_pubchem_cids=[90761]; 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 |
| 250,964 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H32O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H32O3"]… | rdkit_pre_consensus from 'CCCCC(CC)C(=O)OOC(C)(C)CC(C)(C)C'; added: molecular_mass, monoisotopic_mass |
| 258,175 | consensus_match | altLabel | [] | [{"@value":"1,1,3,3-Tetramethylbutyl 2-ethylhexaneperoxoate","@language":"en","source":{"prov:wasGeneratedBy":"consensu… | group_key=1,1,3,3-tetramethylbutyl2-(ethylperoxy)hexanoate||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=22288-43-3; added Common Chemistry CAS names as altLabel: 1,1,3,3-Tetramethylbutyl 2-ethylhexaneperoxoate, 1,1,3,3-Tetramethylbutyl peroxy-2-ethylhexanoate, 2-Pentanol, 2,4,4-trimethyl-, 2-ethylperoxyhexanoate, Hexaneperoxoic acid, 2-ethyl-, 1,1,3,3-tetramethylbutyl ester, Kayaester T, Kayaester TMPO, Kayaester TMPO 70, Lupersol 259, Paokuta O, Percure WO, Perocta O, Perocta O 70S, Peroxyhexanoic acid, 2-ethyl-, 1,1,3,3-tetramethylbutyl ester, Trigonox 421; object_uuid=fo-a74536ca1265953a |
| 258,176 | consensus_match | cas_match_labels | — | {"22288-43-3":"exactMatch"} | group_key=1,1,3,3-tetramethylbutyl2-(ethylperoxy)hexanoate||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory']; cas_sources={'22288-43-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-a74536ca1265953a: {'22288-43-3': 'exactMatch'} |
| 276,150 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H32O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H32O3"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,1,3,3-Tetramethylbutyl 2-ethylhexaneperoxoate' |
| 282,730 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H32O3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H32O3"]… | rdkit_post_consensus from 'CCCCC(CC)C(=O)OOC(C)(C)CC(C)(C)C'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,285 | strip_catalogue_altlabels | altLabel | [{"@value":"1,1,3,3-Tetramethylbutyl 2-ethylhexaneperoxoate","@language":"en","source":{"prov:wasGeneratedBy":"consensu… | [{"@value":"1,1,3,3-Tetramethylbutyl 2-ethylhexaneperoxoate","@language":"en","source":{"prov:wasGeneratedBy":"consensu… | Removed 2 catalogue altLabel value(s): 'Lupersol 259' (trade name), 'Trigonox 421' (trade name) |
| 302,173 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/0984a2c8-7921-… | associations resolved on the elementary layer |
| 302,476 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/0aa15463-00cd-… | associations resolved on the elementary layer |
| 303,888 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/0df42e93-7efd-… | associations resolved on the elementary layer |
| 311,151 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/236ea85a-5545-… | associations resolved on the elementary layer |
| 341,043 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/75fc7526-0bb2-… | associations resolved on the elementary layer |
| 342,544 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/7b5ba250-e3c4-… | associations resolved on the elementary layer |
| 343,029 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/7cf22828-b972-… | associations resolved on the elementary layer |
| 347,460 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/8ba4cd71-c856-… | associations resolved on the elementary layer |
| 359,123 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/b2f2997a-f893-… | associations resolved on the elementary layer |
| 365,265 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/c84f650a-7a7d-… | associations resolved on the elementary layer |
| 368,757 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/d419b9c2-e61f-… | associations resolved on the elementary layer |