2-ethylhexyl Sulfanylacetate
Everything that changed this flow. Back to the flow
f2343d61-aaf9-4f3b-9940-74dbcc7d70c0
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, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'Evabopol 196D' (trade name) |
| 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-ethylhexylsulfanylacetate||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'7659-86-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b61ab14e9634eae6: {'7659-86-1': '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 lower stratosphere and upper troposphere |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['7659-86-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[24309, 34306, 19987598, 23618801, 45108271]; selected_pubchem_cids=[24309]; 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
19| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 456 | bootstrap_labels | prefLabel | — | [{"@value":"2-ethylhexyl sulfanylacetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:was… | Bootstrapped prefLabel from legacy name field |
| 457 | bootstrap_labels | name | 2-ethylhexyl sulfanylacetate | — | Purged legacy name field to enforce prefLabel usage |
| 458 | bootstrap_labels | synonyms | ["organic","2-ethylhexylmercaptoacetate","2-ehma","2-ehtg","2-ethylhexylthioglycolate","2-ethylhexylthioglycolatedist."… | [] | Removed legacy synonyms field in favor of structured labels |
| 195,456 | 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 |
| 195,457 | 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 |
| 213,491 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,199 | normalize_name_case | prefLabel | [{"@value":"2-ethylhexyl sulfanylacetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:was… | [{"@value":"2-ethylhexyl Sulfanylacetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:was… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 227,604 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H20O2S"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 227,605 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 227,606 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J150.356A","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['7659-86-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[24309, 34306, 19987598, 23618801, 45108271]; selected_pubchem_cids=[24309]; 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 |
| 248,438 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H20O2S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H20O2S"… | rdkit_pre_consensus from 'CCCCC(CC)COC(=O)CS'; added: molecular_mass, monoisotopic_mass |
| 260,876 | consensus_match | altLabel | [] | [{"@value":"2-Ethylhexyl 2-mercaptoacetate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wa… | group_key=2-ethylhexylsulfanylacetate||dimension=Environmental > media=Ground > geography=Unknown; cas=7659-86-1; added Common Chemistry CAS names as altLabel: 2-Ethylhexyl 2-mercaptoacetate, 2-Ethylhexyl 2-sulfanylacetate, 2-Ethylhexyl mercaptoacetate, 2-Ethylhexyl thioglycolate, 2-Mercaptoacetic acid 2-ethylhexyl ester, Acetic acid, 2-mercapto-, 2-ethylhexyl ester, Acetic acid, mercapto-, 2-ethylhexyl ester, EHTG, Evabopol 196D, Mercaptoacetic acid 2-ethylhexyl ester; object_uuid=fo-b61ab14e9634eae6 |
| 260,877 | consensus_match | cas_match_labels | — | {"7659-86-1":"exactMatch"} | group_key=2-ethylhexylsulfanylacetate||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'7659-86-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b61ab14e9634eae6: {'7659-86-1': 'exactMatch'} |
| 273,578 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H20O2S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H20O2S"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-ethylhexyl Sulfanylacetate' |
| 279,938 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H20O2S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H20O2S"… | rdkit_post_consensus from 'CCCCC(CC)COC(=O)CS'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,357 | strip_catalogue_altlabels | altLabel | [{"@value":"2-Ethylhexyl 2-mercaptoacetate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wa… | [{"@value":"2-Ethylhexyl 2-mercaptoacetate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wa… | Removed 1 catalogue altLabel value(s): 'Evabopol 196D' (trade name) |
| 378,780 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/f2343d61-aaf9-… | associations resolved on the elementary layer |
| 387,856 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H20O2S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H20O2S"… | typed the way the ontology types it |
| 394,368 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
19 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/20260820T0738569779880000/456 | prefLabel | ef:agent/bootstrap_labels | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v0 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v1 |
| ef:activity/change/20260820T0738569779880000/457 | name | ef:agent/bootstrap_labels | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v1 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v2 |
| ef:activity/change/20260820T0738569779880000/458 | synonyms | ef:agent/bootstrap_labels | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v2 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v3 |
| ef:activity/change/20260820T0738569779880000/195456 | context | ef:agent/default_context_mapping | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v3 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v4 |
| ef:activity/change/20260820T0738569779880000/195457 | context_iri | ef:agent/default_context_mapping | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v4 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v5 |
| ef:activity/change/20260820T0738569779880000/213491 | unit_iri | ef:agent/unit_normalization | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v5 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v6 |
| ef:activity/change/20260820T0738569779880000/221199 | prefLabel | ef:agent/normalize_name_case | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v6 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v7 |
| ef:activity/change/20260820T0738569779880000/227604 | properties | ef:agent/enrich_references | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v7 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v8 |
| ef:activity/change/20260820T0738569779880000/227605 | skos_definition | ef:agent/enrich_references | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v8 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v9 |
| ef:activity/change/20260820T0738569779880000/227606 | references | ef:agent/enrich_references | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v9 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v10 |
| ef:activity/change/20260820T0738569779880000/248438 | properties | ef:agent/rdkit_pre_consensus | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v10 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v11 |
| ef:activity/change/20260820T0738569779880000/260876 | altLabel | ef:agent/consensus_match | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v11 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v12 |
| ef:activity/change/20260820T0738569779880000/260877 | cas_match_labels | ef:agent/consensus_match | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v12 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v13 |
| ef:activity/change/20260820T0738569779880000/273578 | properties | ef:agent/opsin_iupac | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v13 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v14 |
| ef:activity/change/20260820T0738569779880000/279938 | properties | ef:agent/rdkit_post_consensus | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v14 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v15 |
| ef:activity/change/20260820T0738569779880000/287357 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v15 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v16 |
| ef:activity/change/20260820T0738569779880000/378780 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v16 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v17 |
| ef:activity/change/20260820T0738569779880000/387856 | properties | ef:agent/normalise_property_values | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v17 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v18 |
| ef:activity/change/20260820T0738569779880000/394368 | types | ef:agent/link_flows_to_their_substance | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v18 | ef:flow/f2343d61-aaf9-4f3b-9940-74dbcc7d70c0/v19 |