Trifluoromethanesulfonic Acid
Everything that changed this flow. Back to the flow
52db01dc-772d-4ba5-8331-7ef01ef55af1
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 4 | enrich_references, normalise_property_values, opsin_iupac, rdkit_post_consensus | typed the way the ontology types it |
| altLabel | 2 | chebi_altlabels, consensus_match | group_key=trifluoromethanesulfonicacid||dimension=Environmental > media=Ground > geography=Unknown; cas=1493-13-6; added Common Chemistry CAS names as altLabel: 1,1,1-Trifluoro-1-methanesulfonic acid, Fluorad FC 24, Methanesulfonic acid, 1,1,1-trifluoro-, Methanesulfonic acid, trifluoro-, Trifluoromethylsulfonic acid; object_uuid=fo-3cf6844be89ccf8f |
| 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=trifluoromethanesulfonicacid||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'1493-13-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3cf6844be89ccf8f: {'1493-13-6': '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 water > Emissions to water, unspecified (long-term) |
| 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 (long-term) |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['1493-13-6']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_48511']; candidate_pubchem_cids=[62406]; selected_pubchem_cids=[62406]; 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 |
|---|---|---|---|---|---|
| 18,382 | bootstrap_labels | prefLabel | — | [{"@value":"trifluoromethanesulfonic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wa… | Bootstrapped prefLabel from legacy name field |
| 18,383 | bootstrap_labels | name | trifluoromethanesulfonic acid | — | Purged legacy name field to enforce prefLabel usage |
| 18,384 | bootstrap_labels | synonyms | ["organic","trifluoromethanesulphonicacid"] | [] | Removed legacy synonyms field in favor of structured labels |
| 99,168 | 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) |
| 99,169 | 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) |
| 219,348 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 225,284 | normalize_name_case | prefLabel | [{"@value":"trifluoromethanesulfonic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wa… | [{"@value":"Trifluoromethanesulfonic Acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wa… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 244,365 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CHF3O3S"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 244,366 | enrich_references | skos_definition | — | [{"@value":"A one-carbon compound that is methanesulfonic acid in which the hydrogens attached to the methyl carbon hav… | Merged ChEBI/PubChem definitions into skos:definition |
| 244,367 | enrich_references | references | [] | [{"@id":"beilstein:1812100","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":… | Added references with provenance; cas_numbers=['1493-13-6']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_48511']; candidate_pubchem_cids=[62406]; selected_pubchem_cids=[62406]; 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 |
| 256,792 | chebi_altlabels | altLabel | [] | [{"@value":"1,1,1-trifluoromethanesulfonic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","pr… | Added 11 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 272,953 | consensus_match | altLabel | [{"@value":"1,1,1-trifluoromethanesulfonic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","pr… | [{"@value":"1,1,1-trifluoromethanesulfonic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","pr… | group_key=trifluoromethanesulfonicacid||dimension=Environmental > media=Ground > geography=Unknown; cas=1493-13-6; added Common Chemistry CAS names as altLabel: 1,1,1-Trifluoro-1-methanesulfonic acid, Fluorad FC 24, Methanesulfonic acid, 1,1,1-trifluoro-, Methanesulfonic acid, trifluoro-, Trifluoromethylsulfonic acid; object_uuid=fo-3cf6844be89ccf8f |
| 272,954 | consensus_match | cas_match_labels | — | {"1493-13-6":"exactMatch"} | group_key=trifluoromethanesulfonicacid||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'1493-13-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3cf6844be89ccf8f: {'1493-13-6': 'exactMatch'} |
| 278,480 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CHF3O3S"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CHF3O3S"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Trifluoromethanesulfonic Acid' |
| 285,244 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CHF3O3S"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CHF3O3S"],… | rdkit_post_consensus from 'O=S(=O)(O)C(F)(F)F'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 330,581 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/52db01dc-772d-… | associations resolved on the elementary layer |
| 392,847 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CHF3O3S"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CHF3O3S"],… | typed the way the ontology types it |
| 401,506 | 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/20260821T1302361922970000/18382 | prefLabel | ef:agent/bootstrap_labels | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v0 | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v1 |
| ef:activity/change/20260821T1302361922970000/18383 | name | ef:agent/bootstrap_labels | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v1 | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v2 |
| ef:activity/change/20260821T1302361922970000/18384 | synonyms | ef:agent/bootstrap_labels | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v2 | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v3 |
| ef:activity/change/20260821T1302361922970000/99168 | context | ef:agent/default_context_mapping | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v3 | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v4 |
| ef:activity/change/20260821T1302361922970000/99169 | context_iri | ef:agent/default_context_mapping | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v4 | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v5 |
| ef:activity/change/20260821T1302361922970000/219348 | unit_iri | ef:agent/unit_normalization | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v5 | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v6 |
| ef:activity/change/20260821T1302361922970000/225284 | prefLabel | ef:agent/normalize_name_case | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v6 | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v7 |
| ef:activity/change/20260821T1302361922970000/244365 | properties | ef:agent/enrich_references | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v7 | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v8 |
| ef:activity/change/20260821T1302361922970000/244366 | skos_definition | ef:agent/enrich_references | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v8 | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v9 |
| ef:activity/change/20260821T1302361922970000/244367 | references | ef:agent/enrich_references | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v9 | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v10 |
| ef:activity/change/20260821T1302361922970000/256792 | altLabel | ef:agent/chebi_altlabels | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v10 | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v11 |
| ef:activity/change/20260821T1302361922970000/272953 | altLabel | ef:agent/consensus_match | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v11 | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v12 |
| ef:activity/change/20260821T1302361922970000/272954 | cas_match_labels | ef:agent/consensus_match | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v12 | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v13 |
| ef:activity/change/20260821T1302361922970000/278480 | properties | ef:agent/opsin_iupac | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v13 | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v14 |
| ef:activity/change/20260821T1302361922970000/285244 | properties | ef:agent/rdkit_post_consensus | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v14 | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v15 |
| ef:activity/change/20260821T1302361922970000/330581 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v15 | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v16 |
| ef:activity/change/20260821T1302361922970000/392847 | properties | ef:agent/normalise_property_values | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v16 | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v17 |
| ef:activity/change/20260821T1302361922970000/401506 | types | ef:agent/link_flows_to_their_substance | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v17 | ef:flow/52db01dc-772d-4ba5-8331-7ef01ef55af1/v18 |