2-[(allyloxy)methyl]-2-methylbutane-1,1-diol
Everything that changed this flow. Back to the flow
80609bf5-f31a-4146-987a-004e5875e6b2
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 | 1 | consensus_match | group_key=2-[(allyloxy)methyl]-2-methylbutane-1,1-diol||dimension=Environmental > media=Ground > geography=Unknown; cas=682-11-1; added Common Chemistry CAS names as altLabel: 1,1,1-Trimethylolpropane monoallyl ether, 1,3-Propanediol, 2-[(allyloxy)methyl]-2-ethyl-, 1,3-Propanediol, 2-ethyl-2-[(2-propen-1-yloxy)methyl]-, 1,3-Propanediol, 2-ethyl-2-[(2-propenyloxy)methyl]-, 2-Allyloxymethyl-2-ethyl-1,3-propanediol, 2-Ethyl-2-[(2-propen-1-yloxy)methyl]-1,3-propanediol, 2-Ethyl-2-allyloxymethyl-1,3-propanediol, Trimethylolpropane allyl ether, Trimethylolpropane monoallyl ether; object_uuid=fo-3e6843f0532c747f |
| cas_match_labels | 1 | consensus_match | group_key=2-[(allyloxy)methyl]-2-methylbutane-1,1-diol||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'682-11-1': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-3e6843f0532c747f: {'682-11-1': '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, indoor |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 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=['682-11-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[12683, 21585049]; selected_pubchem_cids=[12683]; 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
17| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 4,038 | bootstrap_labels | prefLabel | — | [{"@value":"2-[(allyloxy)methyl]-2-methylbutane-1,1-diol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_l… | Bootstrapped prefLabel from legacy name field |
| 4,039 | bootstrap_labels | name | 2-[(allyloxy)methyl]-2-methylbutane-1,1-diol | — | Purged legacy name field to enforce prefLabel usage |
| 4,040 | bootstrap_labels | synonyms | ["organic","2-allyloxymethyl-2-ethylpropanediol"] | [] | Removed legacy synonyms field in favor of structured labels |
| 126,106 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","indoor":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 126,107 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-indr-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 214,689 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 231,068 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H18O3"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 231,069 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 231,070 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J25.070H","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['682-11-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[12683, 21585049]; selected_pubchem_cids=[12683]; 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 |
| 249,436 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H18O3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H18O3"],… | rdkit_pre_consensus from 'CCC(CO)(CO)COCC=C'; added: molecular_mass, monoisotopic_mass |
| 260,427 | consensus_match | altLabel | [] | [{"@value":"1,1,1-Trimethylolpropane monoallyl ether","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match… | group_key=2-[(allyloxy)methyl]-2-methylbutane-1,1-diol||dimension=Environmental > media=Ground > geography=Unknown; cas=682-11-1; added Common Chemistry CAS names as altLabel: 1,1,1-Trimethylolpropane monoallyl ether, 1,3-Propanediol, 2-[(allyloxy)methyl]-2-ethyl-, 1,3-Propanediol, 2-ethyl-2-[(2-propen-1-yloxy)methyl]-, 1,3-Propanediol, 2-ethyl-2-[(2-propenyloxy)methyl]-, 2-Allyloxymethyl-2-ethyl-1,3-propanediol, 2-Ethyl-2-[(2-propen-1-yloxy)methyl]-1,3-propanediol, 2-Ethyl-2-allyloxymethyl-1,3-propanediol, Trimethylolpropane allyl ether, Trimethylolpropane monoallyl ether; object_uuid=fo-3e6843f0532c747f |
| 260,428 | consensus_match | cas_match_labels | — | {"682-11-1":"exactMatch"} | group_key=2-[(allyloxy)methyl]-2-methylbutane-1,1-diol||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'682-11-1': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-3e6843f0532c747f: {'682-11-1': 'exactMatch'} |
| 274,568 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H18O3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H18O3"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,3-Propanediol, 2-[(allyloxy)methyl]-2-ethyl-' |
| 281,013 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H18O3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H18O3"],… | rdkit_post_consensus from 'C=CCOCC(CC)(CO)CO'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 344,048 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/80609bf5-f31a-… | associations resolved on the elementary layer |
| 388,867 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H18O3"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H18O3"],… | typed the way the ontology types it |
| 395,781 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
17 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/20260821T0609040591070000/4038 | prefLabel | ef:agent/bootstrap_labels | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v0 | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v1 |
| ef:activity/change/20260821T0609040591070000/4039 | name | ef:agent/bootstrap_labels | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v1 | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v2 |
| ef:activity/change/20260821T0609040591070000/4040 | synonyms | ef:agent/bootstrap_labels | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v2 | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v3 |
| ef:activity/change/20260821T0609040591070000/126106 | context | ef:agent/default_context_mapping | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v3 | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v4 |
| ef:activity/change/20260821T0609040591070000/126107 | context_iri | ef:agent/default_context_mapping | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v4 | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v5 |
| ef:activity/change/20260821T0609040591070000/214689 | unit_iri | ef:agent/unit_normalization | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v5 | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v6 |
| ef:activity/change/20260821T0609040591070000/231068 | properties | ef:agent/enrich_references | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v6 | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v7 |
| ef:activity/change/20260821T0609040591070000/231069 | skos_definition | ef:agent/enrich_references | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v7 | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v8 |
| ef:activity/change/20260821T0609040591070000/231070 | references | ef:agent/enrich_references | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v8 | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v9 |
| ef:activity/change/20260821T0609040591070000/249436 | properties | ef:agent/rdkit_pre_consensus | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v9 | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v10 |
| ef:activity/change/20260821T0609040591070000/260427 | altLabel | ef:agent/consensus_match | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v10 | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v11 |
| ef:activity/change/20260821T0609040591070000/260428 | cas_match_labels | ef:agent/consensus_match | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v11 | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v12 |
| ef:activity/change/20260821T0609040591070000/274568 | properties | ef:agent/opsin_iupac | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v12 | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v13 |
| ef:activity/change/20260821T0609040591070000/281013 | properties | ef:agent/rdkit_post_consensus | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v13 | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v14 |
| ef:activity/change/20260821T0609040591070000/344048 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v14 | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v15 |
| ef:activity/change/20260821T0609040591070000/388867 | properties | ef:agent/normalise_property_values | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v15 | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v16 |
| ef:activity/change/20260821T0609040591070000/395781 | types | ef:agent/link_flows_to_their_substance | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v16 | ef:flow/80609bf5-f31a-4146-987a-004e5875e6b2/v17 |