Diisopropylamine
Everything that changed this flow. Back to the flow
c9dadc44-b040-49e5-9e88-36402d7e3f2e
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): 'D 0925' (grade code), 'NSC 6758' (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=diisopropylamine||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'108-18-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-2ed484f7353633db: {'108-18-9': '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 |
| 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 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['108-18-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[7912, 83793, 4667801]; selected_pubchem_cids=[7912]; 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 |
|---|---|---|---|---|---|
| 2,621 | bootstrap_labels | prefLabel | — | [{"@value":"diisopropylamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Bootstrapped prefLabel from legacy name field |
| 2,622 | bootstrap_labels | name | diisopropylamine | — | Purged legacy name field to enforce prefLabel usage |
| 2,623 | bootstrap_labels | synonyms | ["2-Propanamine, N-(1-methylethyl)-","2-Propaneamine, N-(1-methylethyl)-","AB1003532","AC1L1PU6","AC1Q1Q9J","AKOS000120… | [] | Removed legacy synonyms field in favor of structured labels |
| 169,312 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 169,313 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 214,213 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,693 | normalize_name_case | prefLabel | [{"@value":"diisopropylamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | [{"@value":"Diisopropylamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 229,699 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15N"],"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 229,700 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 229,701 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.496F","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['108-18-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[7912, 83793, 4667801]; selected_pubchem_cids=[7912]; 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 |
| 249,044 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15N"],"… | rdkit_pre_consensus from 'CC(C)NC(C)C'; added: molecular_mass, monoisotopic_mass |
| 266,030 | consensus_match | altLabel | [] | [{"@value":"2-Propanamine, <em>N</em>-(1-methylethyl)-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_mat… | group_key=diisopropylamine||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); cas=108-18-9; added Common Chemistry CAS names as altLabel: 2-Propanamine, <em>N</em>-(1-methylethyl)-, <em>N</em>,<em>N</em>-Diisopropylamine, <em>N</em>-(1-Methylethyl)-2-propanamine, <em>N</em>-(Propan-2-yl)propan-2-amine, <em>N</em>-Isopropylpropan-2-amine, Bis(1-methylethyl)amine, Bis(isopropyl)amine, Bis(propan-2-yl)amine, D 0925, NSC 6758; object_uuid=fo-2ed484f7353633db |
| 266,031 | consensus_match | cas_match_labels | — | {"108-18-9":"exactMatch"} | group_key=diisopropylamine||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'108-18-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-2ed484f7353633db: {'108-18-9': 'exactMatch'} |
| 274,164 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15N"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Diisopropylamine' |
| 280,583 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15N"],"… | rdkit_post_consensus from 'CC(C)NC(C)C'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,771 | strip_catalogue_altlabels | altLabel | [{"@value":"2-Propanamine, <em>N</em>-(1-methylethyl)-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_mat… | [{"@value":"2-Propanamine, N-(1-methylethyl)-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov… | Removed 2 catalogue altLabel value(s): 'D 0925' (grade code), 'NSC 6758' (registry code) |
| 365,682 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/c9dadc44-b040-… | associations resolved on the elementary layer |
| 388,455 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15N"],"… | typed the way the ontology types it |
| 395,199 | 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/20260822T0600486828500000/2621 | prefLabel | ef:agent/bootstrap_labels | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v0 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v1 |
| ef:activity/change/20260822T0600486828500000/2622 | name | ef:agent/bootstrap_labels | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v1 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v2 |
| ef:activity/change/20260822T0600486828500000/2623 | synonyms | ef:agent/bootstrap_labels | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v2 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v3 |
| ef:activity/change/20260822T0600486828500000/169312 | context | ef:agent/default_context_mapping | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v3 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v4 |
| ef:activity/change/20260822T0600486828500000/169313 | context_iri | ef:agent/default_context_mapping | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v4 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v5 |
| ef:activity/change/20260822T0600486828500000/214213 | unit_iri | ef:agent/unit_normalization | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v5 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v6 |
| ef:activity/change/20260822T0600486828500000/221693 | prefLabel | ef:agent/normalize_name_case | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v6 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v7 |
| ef:activity/change/20260822T0600486828500000/229699 | properties | ef:agent/enrich_references | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v7 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v8 |
| ef:activity/change/20260822T0600486828500000/229700 | skos_definition | ef:agent/enrich_references | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v8 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v9 |
| ef:activity/change/20260822T0600486828500000/229701 | references | ef:agent/enrich_references | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v9 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v10 |
| ef:activity/change/20260822T0600486828500000/249044 | properties | ef:agent/rdkit_pre_consensus | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v10 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v11 |
| ef:activity/change/20260822T0600486828500000/266030 | altLabel | ef:agent/consensus_match | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v11 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v12 |
| ef:activity/change/20260822T0600486828500000/266031 | cas_match_labels | ef:agent/consensus_match | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v12 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v13 |
| ef:activity/change/20260822T0600486828500000/274164 | properties | ef:agent/opsin_iupac | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v13 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v14 |
| ef:activity/change/20260822T0600486828500000/280583 | properties | ef:agent/rdkit_post_consensus | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v14 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v15 |
| ef:activity/change/20260822T0600486828500000/287771 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v15 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v16 |
| ef:activity/change/20260822T0600486828500000/365682 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v16 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v17 |
| ef:activity/change/20260822T0600486828500000/388455 | properties | ef:agent/normalise_property_values | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v17 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v18 |
| ef:activity/change/20260822T0600486828500000/395199 | types | ef:agent/link_flows_to_their_substance | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v18 | ef:flow/c9dadc44-b040-49e5-9e88-36402d7e3f2e/v19 |