3-(triethoxysilyl)propanenitrile
Everything that changed this flow. Back to the flow
2becea19-c553-4261-a949-9ccd6abe93ef
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): 'NSC 77092' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=3-(triethoxysilyl)propanenitrile||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'919-31-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-9eeca81750796563: {'919-31-3': '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 |
| 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 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['919-31-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[13522, 18705633]; selected_pubchem_cids=[13522]; 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 |
|---|---|---|---|---|---|
| 4,311 | bootstrap_labels | prefLabel | — | [{"@value":"3-(triethoxysilyl)propanenitrile","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov… | Bootstrapped prefLabel from legacy name field |
| 4,312 | bootstrap_labels | name | 3-(triethoxysilyl)propanenitrile | — | Purged legacy name field to enforce prefLabel usage |
| 4,313 | bootstrap_labels | synonyms | ["organometallic","3-(triethoxysilyl)propiononitrile","cne"] | [] | Removed legacy synonyms field in favor of structured labels |
| 66,114 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 66,115 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 214,779 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 231,327 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H19NO3Si… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 231,328 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 231,329 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J21.099D","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['919-31-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[13522, 18705633]; selected_pubchem_cids=[13522]; 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 |
| 249,511 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H19NO3Si… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H19NO3Si… | rdkit_pre_consensus from 'CCO[Si](CCC#N)(OCC)OCC'; added: molecular_mass, monoisotopic_mass |
| 261,825 | consensus_match | altLabel | [] | [{"@value":"(2-Cyanoethyl)triethoxysilane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | group_key=3-(triethoxysilyl)propanenitrile||dimension=Environmental > media=Ground > geography=Non-agricultural; cas=919-31-3; added Common Chemistry CAS names as altLabel: (2-Cyanoethyl)triethoxysilane, (β-Cyanoethyl)triethoxysilane, 3-(Triethoxysilyl)propionitrile, Cyanoethyltriethoxysilane, NSC 77092, Propanenitrile, 3-(triethoxysilyl)-, Propionitrile, 3-(triethoxysilyl)-; object_uuid=fo-9eeca81750796563 |
| 261,826 | consensus_match | cas_match_labels | — | {"919-31-3":"exactMatch"} | group_key=3-(triethoxysilyl)propanenitrile||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'919-31-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-9eeca81750796563: {'919-31-3': 'exactMatch'} |
| 274,640 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H19NO3Si… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H19NO3Si… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '3-(triethoxysilyl)propanenitrile' |
| 281,096 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H19NO3Si… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H19NO3Si… | rdkit_post_consensus from 'CCO[Si](CCC#N)(OCC)OCC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,133 | strip_catalogue_altlabels | altLabel | [{"@value":"(2-Cyanoethyl)triethoxysilane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | [{"@value":"(2-Cyanoethyl)triethoxysilane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | Removed 1 catalogue altLabel value(s): 'NSC 77092' (registry code) |
| 314,072 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/2becea19-c553-… | associations resolved on the elementary layer |
| 388,946 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H19NO3Si… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H19NO3Si… | typed the way the ontology types it |
| 395,896 | 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/20260821T1122181958110000/4311 | prefLabel | ef:agent/bootstrap_labels | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v0 | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v1 |
| ef:activity/change/20260821T1122181958110000/4312 | name | ef:agent/bootstrap_labels | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v1 | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v2 |
| ef:activity/change/20260821T1122181958110000/4313 | synonyms | ef:agent/bootstrap_labels | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v2 | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v3 |
| ef:activity/change/20260821T1122181958110000/66114 | context | ef:agent/default_context_mapping | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v3 | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v4 |
| ef:activity/change/20260821T1122181958110000/66115 | context_iri | ef:agent/default_context_mapping | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v4 | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v5 |
| ef:activity/change/20260821T1122181958110000/214779 | unit_iri | ef:agent/unit_normalization | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v5 | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v6 |
| ef:activity/change/20260821T1122181958110000/231327 | properties | ef:agent/enrich_references | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v6 | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v7 |
| ef:activity/change/20260821T1122181958110000/231328 | skos_definition | ef:agent/enrich_references | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v7 | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v8 |
| ef:activity/change/20260821T1122181958110000/231329 | references | ef:agent/enrich_references | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v8 | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v9 |
| ef:activity/change/20260821T1122181958110000/249511 | properties | ef:agent/rdkit_pre_consensus | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v9 | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v10 |
| ef:activity/change/20260821T1122181958110000/261825 | altLabel | ef:agent/consensus_match | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v10 | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v11 |
| ef:activity/change/20260821T1122181958110000/261826 | cas_match_labels | ef:agent/consensus_match | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v11 | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v12 |
| ef:activity/change/20260821T1122181958110000/274640 | properties | ef:agent/opsin_iupac | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v12 | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v13 |
| ef:activity/change/20260821T1122181958110000/281096 | properties | ef:agent/rdkit_post_consensus | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v13 | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v14 |
| ef:activity/change/20260821T1122181958110000/288133 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v14 | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v15 |
| ef:activity/change/20260821T1122181958110000/314072 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v15 | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v16 |
| ef:activity/change/20260821T1122181958110000/388946 | properties | ef:agent/normalise_property_values | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v16 | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v17 |
| ef:activity/change/20260821T1122181958110000/395896 | types | ef:agent/link_flows_to_their_substance | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v17 | ef:flow/2becea19-c553-4261-a949-9ccd6abe93ef/v18 |