Reaction Product Of 4-methylaniline And 2-methyloxirane
Everything that changed this flow. Back to the flow
fb616a09-166e-49db-87fe-fdc1e993378a
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, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| 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=reactionproductof4-methylanilineand2-methyloxirane||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory']; cas_sources={'38668-48-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-d2f2ea26091c3cbf: {'38668-48-3': '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 soil > Emissions to non-agricultural soil |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['38668-48-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[161976, 219186, 57358040]; selected_pubchem_cids=[161976]; 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 |
|---|---|---|---|---|---|
| 1,568 | bootstrap_labels | prefLabel | — | [{"@value":"reaction product of 4-methylaniline and 2-methyloxirane","@language":"en","source":{"prov:wasGeneratedBy":"… | Bootstrapped prefLabel from legacy name field |
| 1,569 | bootstrap_labels | name | reaction product of 4-methylaniline and 2-methyloxirane | — | Purged legacy name field to enforce prefLabel usage |
| 1,570 | bootstrap_labels | synonyms | ["organic","1,1'","-(p-tolylimino)dipropan-2-ol","2-propanol,1,1'","-(p-tolylimino)di-(7ci)","2-propanol,1,1�… | [] | Removed legacy synonyms field in favor of structured labels |
| 200,726 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Non-agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 200,727 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-noag | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 213,860 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,452 | normalize_name_case | prefLabel | [{"@value":"reaction product of 4-methylaniline and 2-methyloxirane","@language":"en","source":{"prov:wasGeneratedBy":"… | [{"@value":"Reaction Product Of 4-methylaniline And 2-methyloxirane","@language":"en","source":{"prov:wasGeneratedBy":"… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 228,687 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H21NO2"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 228,688 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 228,689 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J153.375D","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['38668-48-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[161976, 219186, 57358040]; selected_pubchem_cids=[161976]; 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 |
| 248,750 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H21NO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H21NO2"… | rdkit_pre_consensus from 'CC1=CC=C(C=C1)N(CC(C)O)CC(C)O'; added: molecular_mass, monoisotopic_mass |
| 271,377 | consensus_match | altLabel | [] | [{"@value":"1,1′-[(4-Methylphenyl)imino]bis[2-propanol]","@language":"en","source":{"prov:wasGeneratedBy":"consensus_ma… | group_key=reactionproductof4-methylanilineand2-methyloxirane||dimension=Environmental > media=Water > water_body=Surface water; cas=38668-48-3; added Common Chemistry CAS names as altLabel: 1,1′-[(4-Methylphenyl)imino]bis[2-propanol], 1-[(2-Hydroxypropyl)(4-methylphenyl)amino]propan-2-ol, 2-Propanol, 1,1′-(<em>p</em>-tolylimino)di-, 2-Propanol, 1,1′-[(4-methylphenyl)imino]bis-, <em>N</em>,<em>N</em>-Bis(2-hydroxypropyl)-4-methylaniline, <em>N</em>,<em>N</em>-Bis(2-hydroxypropyl)-<em>p</em>-toluidine, <em>N</em>,<em>N</em>-Di(2-hydroxypropyl)-<em>p</em>-toluidine, <em>N</em>,<em>N</em>-Diisopropanol-<em>p</em>-toluidine, Diisopropanol-<em>p</em>-toluidine; object_uuid=fo-d2f2ea26091c3cbf |
| 271,378 | consensus_match | cas_match_labels | — | {"38668-48-3":"exactMatch"} | group_key=reactionproductof4-methylanilineand2-methyloxirane||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory']; cas_sources={'38668-48-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-d2f2ea26091c3cbf: {'38668-48-3': 'exactMatch'} |
| 273,871 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H21NO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H21NO2"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,1′-[(4-Methylphenyl)imino]bis[2-propanol]' |
| 280,260 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H21NO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H21NO2"… | rdkit_post_consensus from 'Cc1ccc(N(CC(C)O)CC(C)O)cc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,032 | dedupe_altlabels | altLabel | [{"@value":"1,1′-[(4-Methylphenyl)imino]bis[2-propanol]","@language":"en","source":{"prov:wasGeneratedBy":"consensus_ma… | [{"@value":"1,1′-[(4-Methylphenyl)imino]bis[2-propanol]","@language":"en","source":{"prov:wasGeneratedBy":"consensus_ma… | Deduplicated altLabel values and removed entries matching prefLabel |
| 381,390 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/fb616a09-166e-… | associations resolved on the elementary layer |
| 388,154 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H21NO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H21NO2"… | typed the way the ontology types it |
| 394,773 | 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/20260820T1812399309960000/1568 | prefLabel | ef:agent/bootstrap_labels | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v0 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v1 |
| ef:activity/change/20260820T1812399309960000/1569 | name | ef:agent/bootstrap_labels | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v1 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v2 |
| ef:activity/change/20260820T1812399309960000/1570 | synonyms | ef:agent/bootstrap_labels | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v2 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v3 |
| ef:activity/change/20260820T1812399309960000/200726 | context | ef:agent/default_context_mapping | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v3 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v4 |
| ef:activity/change/20260820T1812399309960000/200727 | context_iri | ef:agent/default_context_mapping | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v4 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v5 |
| ef:activity/change/20260820T1812399309960000/213860 | unit_iri | ef:agent/unit_normalization | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v5 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v6 |
| ef:activity/change/20260820T1812399309960000/221452 | prefLabel | ef:agent/normalize_name_case | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v6 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v7 |
| ef:activity/change/20260820T1812399309960000/228687 | properties | ef:agent/enrich_references | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v7 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v8 |
| ef:activity/change/20260820T1812399309960000/228688 | skos_definition | ef:agent/enrich_references | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v8 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v9 |
| ef:activity/change/20260820T1812399309960000/228689 | references | ef:agent/enrich_references | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v9 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v10 |
| ef:activity/change/20260820T1812399309960000/248750 | properties | ef:agent/rdkit_pre_consensus | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v10 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v11 |
| ef:activity/change/20260820T1812399309960000/271377 | altLabel | ef:agent/consensus_match | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v11 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v12 |
| ef:activity/change/20260820T1812399309960000/271378 | cas_match_labels | ef:agent/consensus_match | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v12 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v13 |
| ef:activity/change/20260820T1812399309960000/273871 | properties | ef:agent/opsin_iupac | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v13 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v14 |
| ef:activity/change/20260820T1812399309960000/280260 | properties | ef:agent/rdkit_post_consensus | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v14 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v15 |
| ef:activity/change/20260820T1812399309960000/292032 | altLabel | ef:agent/dedupe_altlabels | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v15 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v16 |
| ef:activity/change/20260820T1812399309960000/381390 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v16 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v17 |
| ef:activity/change/20260820T1812399309960000/388154 | properties | ef:agent/normalise_property_values | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v17 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v18 |
| ef:activity/change/20260820T1812399309960000/394773 | types | ef:agent/link_flows_to_their_substance | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v18 | ef:flow/fb616a09-166e-49db-87fe-fdc1e993378a/v19 |