(1-methyl-1-phenylethyl)phenyl Diphenyl Phosphate
Everything that changed this flow. Back to the flow
189152d3-c56e-4ee9-951d-e8ee3d4ed4d8
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 5 | enrich_references, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus, withhold_ambiguous_mass | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| altLabel | 1 | consensus_match | group_key=(1-methyl-1-phenylethyl)phenyldiphenylphosphate||dimension=Environmental > media=Water > water_body=Surface water; cas=34364-42-6; added Common Chemistry CAS names as altLabel: Cumylphenyldiphenylphosphate, Phosphoric acid, (1-methyl-1-phenylethyl)phenyl diphenyl ester, Phosphoric acid, (α,α-dimethylbenzyl)phenyl diphenyl ester, α,α-Dimethylbenzylphenyl diphenyl phosphate; object_uuid=fo-96a91315c6effcea |
| cas_match_labels | 1 | consensus_match | group_key=(1-methyl-1-phenylethyl)phenyldiphenylphosphate||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'34364-42-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-96a91315c6effcea: {'34364-42-6': '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 soil, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['34364-42-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[36800, 20295726, 73555740]; selected_pubchem_cids=[36800]; 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 |
|---|---|---|---|---|---|
| 6,199 | bootstrap_labels | prefLabel | — | [{"@value":"(1-methyl-1-phenylethyl)phenyl diphenyl phosphate","@language":"en","source":{"prov:wasGeneratedBy":"bootst… | Bootstrapped prefLabel from legacy name field |
| 6,200 | bootstrap_labels | name | (1-methyl-1-phenylethyl)phenyl diphenyl phosphate | — | Purged legacy name field to enforce prefLabel usage |
| 6,201 | bootstrap_labels | synonyms | ["AC1L1WF0","CUMYLPHENYL DIPHENYL PHOSPHATE","Phosphoric acid, (1-methyl-1-phenylethyl)phenyl diphenyl ester","diphenyl… | [] | Removed legacy synonyms field in favor of structured labels |
| 52,774 | 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 |
| 52,775 | 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 |
| 215,417 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,532 | normalize_name_case | prefLabel | [{"@value":"(1-methyl-1-phenylethyl)phenyl diphenyl phosphate","@language":"en","source":{"prov:wasGeneratedBy":"bootst… | [{"@value":"(1-methyl-1-phenylethyl)phenyl Diphenyl Phosphate","@language":"en","source":{"prov:wasGeneratedBy":"bootst… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 233,151 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C27H25O4P"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 233,152 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 233,153 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.047.226","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['34364-42-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[36800, 20295726, 73555740]; selected_pubchem_cids=[36800]; 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 |
| 250,044 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C27H25O4P"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C27H25O4P"… | rdkit_pre_consensus from 'CC(C)C1=CC(=CC(=C1)C2=CC=CC=C2)OP(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4'; added: molecular_mass, monoisotopic_mass |
| 257,541 | consensus_match | altLabel | [] | [{"@value":"Cumylphenyldiphenylphosphate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasA… | group_key=(1-methyl-1-phenylethyl)phenyldiphenylphosphate||dimension=Environmental > media=Water > water_body=Surface water; cas=34364-42-6; added Common Chemistry CAS names as altLabel: Cumylphenyldiphenylphosphate, Phosphoric acid, (1-methyl-1-phenylethyl)phenyl diphenyl ester, Phosphoric acid, (α,α-dimethylbenzyl)phenyl diphenyl ester, α,α-Dimethylbenzylphenyl diphenyl phosphate; object_uuid=fo-96a91315c6effcea |
| 257,542 | consensus_match | cas_match_labels | — | {"34364-42-6":"exactMatch"} | group_key=(1-methyl-1-phenylethyl)phenyldiphenylphosphate||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'34364-42-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-96a91315c6effcea: {'34364-42-6': 'exactMatch'} |
| 275,196 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C27H25O4P"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C27H25O4P"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '(1-methyl-1-phenylethyl)phenyl Diphenyl Phosphate' |
| 281,690 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C27H25O4P"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C27H25O4P"… | rdkit_post_consensus from 'CC(C)(c1ccccc1)c1ccccc1OP(=O)(Oc1ccccc1)Oc1ccccc1'; added: inchi2d_key_string; confirmed: smiles_string, inchi2d_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 286,875 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C27H25O4P"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C27H25O4P"… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 307,435 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/189152d3-c56e-… | associations resolved on the elementary layer |
| 396,667 | 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/20260820T0738569779880000/6199 | prefLabel | ef:agent/bootstrap_labels | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v0 | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v1 |
| ef:activity/change/20260820T0738569779880000/6200 | name | ef:agent/bootstrap_labels | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v1 | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v2 |
| ef:activity/change/20260820T0738569779880000/6201 | synonyms | ef:agent/bootstrap_labels | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v2 | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v3 |
| ef:activity/change/20260820T0738569779880000/52774 | context | ef:agent/default_context_mapping | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v3 | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v4 |
| ef:activity/change/20260820T0738569779880000/52775 | context_iri | ef:agent/default_context_mapping | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v4 | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v5 |
| ef:activity/change/20260820T0738569779880000/215417 | unit_iri | ef:agent/unit_normalization | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v5 | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v6 |
| ef:activity/change/20260820T0738569779880000/222532 | prefLabel | ef:agent/normalize_name_case | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v6 | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v7 |
| ef:activity/change/20260820T0738569779880000/233151 | properties | ef:agent/enrich_references | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v7 | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v8 |
| ef:activity/change/20260820T0738569779880000/233152 | skos_definition | ef:agent/enrich_references | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v8 | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v9 |
| ef:activity/change/20260820T0738569779880000/233153 | references | ef:agent/enrich_references | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v9 | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v10 |
| ef:activity/change/20260820T0738569779880000/250044 | properties | ef:agent/rdkit_pre_consensus | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v10 | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v11 |
| ef:activity/change/20260820T0738569779880000/257541 | altLabel | ef:agent/consensus_match | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v11 | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v12 |
| ef:activity/change/20260820T0738569779880000/257542 | cas_match_labels | ef:agent/consensus_match | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v12 | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v13 |
| ef:activity/change/20260820T0738569779880000/275196 | properties | ef:agent/opsin_iupac | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v13 | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v14 |
| ef:activity/change/20260820T0738569779880000/281690 | properties | ef:agent/rdkit_post_consensus | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v14 | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v15 |
| ef:activity/change/20260820T0738569779880000/286875 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v15 | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v16 |
| ef:activity/change/20260820T0738569779880000/307435 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v16 | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v17 |
| ef:activity/change/20260820T0738569779880000/396667 | types | ef:agent/link_flows_to_their_substance | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v17 | ef:flow/189152d3-c56e-4ee9-951d-e8ee3d4ed4d8/v18 |