4-tert-butylcyclohexyl Acetate, Cis
Everything that changed this flow. Back to the flow
f52fba25-1f62-494d-a6de-105d43315c97
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=4-tert-butylcyclohexylacetate,cis||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['ec_inventory']; cas_sources={'10411-92-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-2db60807f3b1660e: {'10411-92-4': '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 water > Emissions to water, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['10411-92-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[36081]; selected_pubchem_cids=[36081]; 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 |
|---|---|---|---|---|---|
| 126 | bootstrap_labels | prefLabel | — | [{"@value":"4-tert-butylcyclohexyl acetate, cis","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","p… | Bootstrapped prefLabel from legacy name field |
| 127 | bootstrap_labels | name | 4-tert-butylcyclohexyl acetate, cis | — | Purged legacy name field to enforce prefLabel usage |
| 128 | bootstrap_labels | synonyms | ["organic","cis-4-tert-butylcyclohexylacetate"] | [] | Removed legacy synonyms field in favor of structured labels |
| 197,156 | 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 |
| 197,157 | 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 |
| 213,380 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,126 | normalize_name_case | prefLabel | [{"@value":"4-tert-butylcyclohexyl acetate, cis","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","p… | [{"@value":"4-tert-butylcyclohexyl Acetate, Cis","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","p… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 227,289 | 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, stereochemistry_restored_cas=['10411-92-4']) |
| 227,290 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 227,291 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J46.191A","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['10411-92-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[36081]; selected_pubchem_cids=[36081]; 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 |
| 248,346 | 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)OC1CCC(CC1)C(C)(C)C'; added: molecular_mass, monoisotopic_mass |
| 262,958 | consensus_match | altLabel | [] | [{"@value":"<em>cis</em>-1-Acetoxy-4-<em>tert</em>-butylcyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"… | group_key=4-tert-butylcyclohexylacetate,cis||dimension=Environmental > media=Water > water_body=Ocean; cas=10411-92-4; added Common Chemistry CAS names as altLabel: <em>cis</em>-1-Acetoxy-4-<em>tert</em>-butylcyclohexane, <em>cis</em>-4-<em>tert</em>-Butyl-1-acetoxycyclohexane, <em>cis</em>-4-<em>tert</em>-Butylcyclohexyl acetate, <em>cis</em>-<em>p</em>-<em>tert</em>-Butylcyclohexyl acetate, Cyclohexanol, 4-(1,1-dimethylethyl)-, 1-acetate, <em>cis</em>-, Cyclohexanol, 4-(1,1-dimethylethyl)-, acetate, <em>cis</em>-, Cyclohexanol, 4-<em>tert</em>-butyl-, acetate, <em>cis</em>-, PTBCA 25-cis; object_uuid=fo-2db60807f3b1660e |
| 262,959 | consensus_match | cas_match_labels | — | {"10411-92-4":"exactMatch"} | group_key=4-tert-butylcyclohexylacetate,cis||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['ec_inventory']; cas_sources={'10411-92-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-2db60807f3b1660e: {'10411-92-4': 'exactMatch'} |
| 273,489 | 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-1-Acetoxy-4-tert-butylcyclohexane' |
| 279,840 | 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]1CC[C@@H](C(C)(C)C)CC1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 291,970 | dedupe_altlabels | altLabel | [{"@value":"<em>cis</em>-1-Acetoxy-4-<em>tert</em>-butylcyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"… | [{"@value":"cis-1-Acetoxy-4-tert-butylcyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","… | Deduplicated altLabel values and removed entries matching prefLabel |
| 379,632 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/f52fba25-1f62-… | associations resolved on the elementary layer |
| 387,767 | 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 |
| 394,234 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 394,235 | 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/20260820T0738569779880000/126 | prefLabel | ef:agent/bootstrap_labels | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v0 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v1 |
| ef:activity/change/20260820T0738569779880000/127 | name | ef:agent/bootstrap_labels | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v1 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v2 |
| ef:activity/change/20260820T0738569779880000/128 | synonyms | ef:agent/bootstrap_labels | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v2 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v3 |
| ef:activity/change/20260820T0738569779880000/197156 | context | ef:agent/default_context_mapping | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v3 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v4 |
| ef:activity/change/20260820T0738569779880000/197157 | context_iri | ef:agent/default_context_mapping | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v4 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v5 |
| ef:activity/change/20260820T0738569779880000/213380 | unit_iri | ef:agent/unit_normalization | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v5 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v6 |
| ef:activity/change/20260820T0738569779880000/221126 | prefLabel | ef:agent/normalize_name_case | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v6 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v7 |
| ef:activity/change/20260820T0738569779880000/227289 | properties | ef:agent/enrich_references | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v7 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v8 |
| ef:activity/change/20260820T0738569779880000/227290 | skos_definition | ef:agent/enrich_references | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v8 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v9 |
| ef:activity/change/20260820T0738569779880000/227291 | references | ef:agent/enrich_references | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v9 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v10 |
| ef:activity/change/20260820T0738569779880000/248346 | properties | ef:agent/rdkit_pre_consensus | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v10 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v11 |
| ef:activity/change/20260820T0738569779880000/262958 | altLabel | ef:agent/consensus_match | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v11 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v12 |
| ef:activity/change/20260820T0738569779880000/262959 | cas_match_labels | ef:agent/consensus_match | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v12 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v13 |
| ef:activity/change/20260820T0738569779880000/273489 | properties | ef:agent/opsin_iupac | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v13 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v14 |
| ef:activity/change/20260820T0738569779880000/279840 | properties | ef:agent/rdkit_post_consensus | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v14 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v15 |
| ef:activity/change/20260820T0738569779880000/291970 | altLabel | ef:agent/dedupe_altlabels | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v15 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v16 |
| ef:activity/change/20260820T0738569779880000/379632 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v16 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v17 |
| ef:activity/change/20260820T0738569779880000/387767 | properties | ef:agent/normalise_property_values | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v17 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v18 |
| ef:activity/change/20260820T0738569779880000/394234 | types | ef:agent/link_flows_to_their_substance | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v18 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v19 |
| ef:activity/change/20260820T0738569779880000/394235 | properties | ef:agent/link_flows_to_their_substance | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v19 | ef:flow/f52fba25-1f62-494d-a6de-105d43315c97/v20 |