2-(2-butoxyethoxy)ethyl Thiocyanate
Everything that changed this flow. Back to the flow
f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4
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 2 catalogue altLabel value(s): 'Lethane 384' (trade name), 'NSC 3534' (registry code) |
| 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-(2-butoxyethoxy)ethylthiocyanate||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'112-56-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-729e737a5808046f: {'112-56-1': '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 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=['112-56-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[8196]; selected_pubchem_cids=[8196]; 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 |
|---|---|---|---|---|---|
| 9,336 | bootstrap_labels | prefLabel | — | [{"@value":"2-(2-butoxyethoxy)ethyl thiocyanate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","p… | Bootstrapped prefLabel from legacy name field |
| 9,337 | bootstrap_labels | name | 2-(2-butoxyethoxy)ethyl thiocyanate | — | Purged legacy name field to enforce prefLabel usage |
| 9,338 | bootstrap_labels | synonyms | [".beta.-Butoxy-.beta.'-thiocyanodiethyl ether","1-Butoxy-2-(2-thiocyanoethoxy)ethane","1-Butoxy-alpha-(2-thiocyanoetho… | [] | Removed legacy synonyms field in favor of structured labels |
| 195,720 | 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) |
| 195,721 | 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) |
| 216,444 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,289 | normalize_name_case | prefLabel | [{"@value":"2-(2-butoxyethoxy)ethyl thiocyanate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","p… | [{"@value":"2-(2-butoxyethoxy)ethyl Thiocyanate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","p… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 236,111 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H17NO2S"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 236,112 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 236,113 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.128D","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['112-56-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[8196]; selected_pubchem_cids=[8196]; 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 |
| 250,884 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H17NO2S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H17NO2S"… | rdkit_pre_consensus from 'CCCCOCCOCCSC#N'; added: molecular_mass, monoisotopic_mass |
| 260,230 | consensus_match | altLabel | [] | [{"@value":"1-(2-(2-Thiocyanatoethoxy)ethoxy)butane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match"… | group_key=2-(2-butoxyethoxy)ethylthiocyanate||dimension=Environmental > media=Ground > geography=Non-agricultural; cas=112-56-1; added Common Chemistry CAS names as altLabel: 1-(2-(2-Thiocyanatoethoxy)ethoxy)butane, 1-Butoxy-2-(2-thiocyanoethoxy)ethane, 3,6-Dioxadecyl thiocyanate, Butyl carbitol rhodanate, Butyl carbitol thiocyanate, Lethane, Lethane 384, NSC 3534, Thiocyanic acid, 2-(2-butoxyethoxy)ethyl ester; object_uuid=fo-729e737a5808046f |
| 260,231 | consensus_match | cas_match_labels | — | {"112-56-1":"exactMatch"} | group_key=2-(2-butoxyethoxy)ethylthiocyanate||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'112-56-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-729e737a5808046f: {'112-56-1': 'exactMatch'} |
| 276,068 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H17NO2S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H17NO2S"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-(2-butoxyethoxy)ethyl Thiocyanate' |
| 282,637 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H17NO2S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H17NO2S"… | rdkit_post_consensus from 'CCCCOCCOCCSC#N'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,206 | strip_catalogue_altlabels | altLabel | [{"@value":"1-(2-(2-Thiocyanatoethoxy)ethoxy)butane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match"… | [{"@value":"1-(2-(2-Thiocyanatoethoxy)ethoxy)butane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match"… | Removed 2 catalogue altLabel value(s): 'Lethane 384' (trade name), 'NSC 3534' (registry code) |
| 378,885 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/f2a2f02b-ecc6-… | associations resolved on the elementary layer |
| 390,408 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H17NO2S"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H17NO2S"… | typed the way the ontology types it |
| 398,003 | 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/20260821T0609040591070000/9336 | prefLabel | ef:agent/bootstrap_labels | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v0 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v1 |
| ef:activity/change/20260821T0609040591070000/9337 | name | ef:agent/bootstrap_labels | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v1 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v2 |
| ef:activity/change/20260821T0609040591070000/9338 | synonyms | ef:agent/bootstrap_labels | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v2 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v3 |
| ef:activity/change/20260821T0609040591070000/195720 | context | ef:agent/default_context_mapping | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v3 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v4 |
| ef:activity/change/20260821T0609040591070000/195721 | context_iri | ef:agent/default_context_mapping | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v4 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v5 |
| ef:activity/change/20260821T0609040591070000/216444 | unit_iri | ef:agent/unit_normalization | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v5 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v6 |
| ef:activity/change/20260821T0609040591070000/223289 | prefLabel | ef:agent/normalize_name_case | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v6 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v7 |
| ef:activity/change/20260821T0609040591070000/236111 | properties | ef:agent/enrich_references | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v7 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v8 |
| ef:activity/change/20260821T0609040591070000/236112 | skos_definition | ef:agent/enrich_references | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v8 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v9 |
| ef:activity/change/20260821T0609040591070000/236113 | references | ef:agent/enrich_references | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v9 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v10 |
| ef:activity/change/20260821T0609040591070000/250884 | properties | ef:agent/rdkit_pre_consensus | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v10 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v11 |
| ef:activity/change/20260821T0609040591070000/260230 | altLabel | ef:agent/consensus_match | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v11 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v12 |
| ef:activity/change/20260821T0609040591070000/260231 | cas_match_labels | ef:agent/consensus_match | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v12 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v13 |
| ef:activity/change/20260821T0609040591070000/276068 | properties | ef:agent/opsin_iupac | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v13 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v14 |
| ef:activity/change/20260821T0609040591070000/282637 | properties | ef:agent/rdkit_post_consensus | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v14 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v15 |
| ef:activity/change/20260821T0609040591070000/289206 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v15 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v16 |
| ef:activity/change/20260821T0609040591070000/378885 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v16 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v17 |
| ef:activity/change/20260821T0609040591070000/390408 | properties | ef:agent/normalise_property_values | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v17 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v18 |
| ef:activity/change/20260821T0609040591070000/398003 | types | ef:agent/link_flows_to_their_substance | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v18 | ef:flow/f2a2f02b-ecc6-4279-a9d4-e5ec71d4c6a4/v19 |