2-tert-butylcyclohexyl Acetate
Everything that changed this flow. Back to the flow
0c33c6eb-31ef-47fb-8e07-95f1882629d7
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 6 | enrich_references, link_flows_to_their_substance, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus | the substance's answer, copied onto its flow |
| altLabel | 2 | consensus_match, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| cas_match_labels | 1 | consensus_match | group_key=2-tert-butylcyclohexylacetate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory']; cas_sources={'20298-69-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-dd0b408523d393cd: {'20298-69-5': '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 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 |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['20298-69-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[62334, 88480, 293790, 21116400]; selected_pubchem_cids=[21116400]; 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
20| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 1,474 | bootstrap_labels | prefLabel | — | [{"@value":"2-tert-butylcyclohexyl acetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:w… | Bootstrapped prefLabel from legacy name field |
| 1,475 | bootstrap_labels | name | 2-tert-butylcyclohexyl acetate | — | Purged legacy name field to enforce prefLabel usage |
| 1,476 | bootstrap_labels | synonyms | ["organic","cis-2-tert-butylcyclohexylacetate","agrumex","beldox","ortholate","otbcha","verdox"] | [] | Removed legacy synonyms field in favor of structured labels |
| 43,668 | 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) |
| 43,669 | 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) |
| 213,827 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,430 | normalize_name_case | prefLabel | [{"@value":"2-tert-butylcyclohexyl acetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:w… | [{"@value":"2-tert-butylcyclohexyl Acetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:w… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 228,593 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 228,594 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 228,595 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J46.178D","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['20298-69-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[62334, 88480, 293790, 21116400]; selected_pubchem_cids=[21116400]; 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 |
| 248,722 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O2"]… | rdkit_pre_consensus from 'CC(=O)OC1CCCCC1C(C)(C)C'; added: inchi2d_string, molecular_mass, monoisotopic_mass |
| 261,347 | consensus_match | altLabel | [] | [{"@value":"<em>cis</em>-2-<em>tert</em>-Butylcyclohexyl acetate","@language":"en","source":{"prov:wasGeneratedBy":"con… | group_key=2-tert-butylcyclohexylacetate||dimension=Environmental > media=Water > water_body=Unknown; cas=20298-69-5; added Common Chemistry CAS names as altLabel: <em>cis</em>-2-<em>tert</em>-Butylcyclohexyl acetate, Agrumex, Cyclohexanol, 2-(1,1-dimethylethyl)-, 1-acetate, (1<em>R</em>,2<em>R</em>)-<em>rel</em>-, Cyclohexanol, 2-(1,1-dimethylethyl)-, acetate, (1<em>R</em>,2<em>R</em>)-<em>rel</em>-, Cyclohexanol, 2-(1,1-dimethylethyl)-, acetate, <em>cis</em>-, Cyclohexanol, 2-<em>tert</em>-butyl-, acetate, <em>cis</em>-; object_uuid=fo-dd0b408523d393cd |
| 261,348 | consensus_match | cas_match_labels | — | {"20298-69-5":"exactMatch"} | group_key=2-tert-butylcyclohexylacetate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory']; cas_sources={'20298-69-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-dd0b408523d393cd: {'20298-69-5': 'exactMatch'} |
| 273,841 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'cis-2-tert-Butylcyclohexyl acetate' |
| 280,230 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O2"]… | rdkit_post_consensus from 'CC(=O)O[C@@H]1CCCC[C@@H]1C(C)(C)C'; added: inchi2d_key_string; confirmed: smiles_string, inchi2d_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,024 | dedupe_altlabels | altLabel | [{"@value":"<em>cis</em>-2-<em>tert</em>-Butylcyclohexyl acetate","@language":"en","source":{"prov:wasGeneratedBy":"con… | [{"@value":"cis-2-tert-Butylcyclohexyl acetate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pro… | Deduplicated altLabel values and removed entries matching prefLabel |
| 302,853 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/0c33c6eb-31ef-… | associations resolved on the elementary layer |
| 388,125 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O2"]… | typed the way the ontology types it |
| 394,734 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 394,735 | link_flows_to_their_substance | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O2"]… | the substance's answer, copied onto its flow |
PROV-O trail
20 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/20260820T1812399309960000/1474 | prefLabel | ef:agent/bootstrap_labels | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v0 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v1 |
| ef:activity/change/20260820T1812399309960000/1475 | name | ef:agent/bootstrap_labels | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v1 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v2 |
| ef:activity/change/20260820T1812399309960000/1476 | synonyms | ef:agent/bootstrap_labels | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v2 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v3 |
| ef:activity/change/20260820T1812399309960000/43668 | context | ef:agent/default_context_mapping | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v3 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v4 |
| ef:activity/change/20260820T1812399309960000/43669 | context_iri | ef:agent/default_context_mapping | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v4 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v5 |
| ef:activity/change/20260820T1812399309960000/213827 | unit_iri | ef:agent/unit_normalization | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v5 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v6 |
| ef:activity/change/20260820T1812399309960000/221430 | prefLabel | ef:agent/normalize_name_case | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v6 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v7 |
| ef:activity/change/20260820T1812399309960000/228593 | properties | ef:agent/enrich_references | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v7 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v8 |
| ef:activity/change/20260820T1812399309960000/228594 | skos_definition | ef:agent/enrich_references | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v8 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v9 |
| ef:activity/change/20260820T1812399309960000/228595 | references | ef:agent/enrich_references | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v9 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v10 |
| ef:activity/change/20260820T1812399309960000/248722 | properties | ef:agent/rdkit_pre_consensus | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v10 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v11 |
| ef:activity/change/20260820T1812399309960000/261347 | altLabel | ef:agent/consensus_match | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v11 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v12 |
| ef:activity/change/20260820T1812399309960000/261348 | cas_match_labels | ef:agent/consensus_match | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v12 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v13 |
| ef:activity/change/20260820T1812399309960000/273841 | properties | ef:agent/opsin_iupac | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v13 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v14 |
| ef:activity/change/20260820T1812399309960000/280230 | properties | ef:agent/rdkit_post_consensus | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v14 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v15 |
| ef:activity/change/20260820T1812399309960000/292024 | altLabel | ef:agent/dedupe_altlabels | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v15 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v16 |
| ef:activity/change/20260820T1812399309960000/302853 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v16 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v17 |
| ef:activity/change/20260820T1812399309960000/388125 | properties | ef:agent/normalise_property_values | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v17 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v18 |
| ef:activity/change/20260820T1812399309960000/394734 | types | ef:agent/link_flows_to_their_substance | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v18 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v19 |
| ef:activity/change/20260820T1812399309960000/394735 | properties | ef:agent/link_flows_to_their_substance | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v19 | ef:flow/0c33c6eb-31ef-47fb-8e07-95f1882629d7/v20 |