2-[2-(2-acetyloxyethoxy)ethoxy]ethyl Acetate
Everything that changed this flow. Back to the flow
dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6
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): 'Estol 1593' (trade name), 'NSC 2591' (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-(2-acetyloxyethoxy)ethoxy]ethylacetate||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'111-21-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5560b0ac594d3622: {'111-21-7': '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=['111-21-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[8098, 56924027]; selected_pubchem_cids=[8098]; 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 |
|---|---|---|---|---|---|
| 17,068 | bootstrap_labels | prefLabel | — | [{"@value":"2-[2-(2-acetyloxyethoxy)ethoxy]ethyl acetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_l… | Bootstrapped prefLabel from legacy name field |
| 17,069 | bootstrap_labels | name | 2-[2-(2-acetyloxyethoxy)ethoxy]ethyl acetate | — | Purged legacy name field to enforce prefLabel usage |
| 17,070 | bootstrap_labels | synonyms | ["organic","2,2'","-[ethane-1,2-diylbis(oxy)]bisethyldiacetate"] | [] | Removed legacy synonyms field in favor of structured labels |
| 180,794 | 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) |
| 180,795 | 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) |
| 218,937 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,999 | normalize_name_case | prefLabel | [{"@value":"2-[2-(2-acetyloxyethoxy)ethoxy]ethyl acetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_l… | [{"@value":"2-[2-(2-acetyloxyethoxy)ethoxy]ethyl Acetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_l… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 243,202 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18O6"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 243,203 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 243,204 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J58.261A","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['111-21-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[8098, 56924027]; selected_pubchem_cids=[8098]; 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 |
| 252,929 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18O6"]… | rdkit_pre_consensus from 'CC(=O)OCCOCCOCCOC(=O)C'; added: molecular_mass, monoisotopic_mass |
| 260,435 | consensus_match | altLabel | [] | [{"@value":"1,8-Diacetoxy-3,6-dioxaoctane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | group_key=2-[2-(2-acetyloxyethoxy)ethoxy]ethylacetate||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); cas=111-21-7; added Common Chemistry CAS names as altLabel: 1,8-Diacetoxy-3,6-dioxaoctane, Clextral BC 21, Estol 1593, Ethanol, 2,2′-[1,2-ethanediylbis(oxy)]bis-, 1,1′-diacetate, Ethanol, 2,2′-[1,2-ethanediylbis(oxy)]bis-, diacetate, NSC 2591, Triethylene glycol, diacetate, Triglycol diacetate; object_uuid=fo-5560b0ac594d3622 |
| 260,436 | consensus_match | cas_match_labels | — | {"111-21-7":"exactMatch"} | group_key=2-[2-(2-acetyloxyethoxy)ethoxy]ethylacetate||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'111-21-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5560b0ac594d3622: {'111-21-7': 'exactMatch'} |
| 278,131 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18O6"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-[2-(2-acetyloxyethoxy)ethoxy]ethyl Acetate' |
| 284,870 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18O6"]… | rdkit_post_consensus from 'CC(=O)OCCOCCOCCOC(C)=O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,719 | strip_catalogue_altlabels | altLabel | [{"@value":"1,8-Diacetoxy-3,6-dioxaoctane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | [{"@value":"1,8-Diacetoxy-3,6-dioxaoctane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | Removed 2 catalogue altLabel value(s): 'Estol 1593' (trade name), 'NSC 2591' (registry code) |
| 371,421 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/dbbc2a4e-0b5b-… | associations resolved on the elementary layer |
| 392,487 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H18O6"]… | typed the way the ontology types it |
| 400,989 | 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/20260821T1122181958110000/17068 | prefLabel | ef:agent/bootstrap_labels | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v0 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v1 |
| ef:activity/change/20260821T1122181958110000/17069 | name | ef:agent/bootstrap_labels | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v1 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v2 |
| ef:activity/change/20260821T1122181958110000/17070 | synonyms | ef:agent/bootstrap_labels | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v2 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v3 |
| ef:activity/change/20260821T1122181958110000/180794 | context | ef:agent/default_context_mapping | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v3 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v4 |
| ef:activity/change/20260821T1122181958110000/180795 | context_iri | ef:agent/default_context_mapping | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v4 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v5 |
| ef:activity/change/20260821T1122181958110000/218937 | unit_iri | ef:agent/unit_normalization | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v5 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v6 |
| ef:activity/change/20260821T1122181958110000/224999 | prefLabel | ef:agent/normalize_name_case | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v6 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v7 |
| ef:activity/change/20260821T1122181958110000/243202 | properties | ef:agent/enrich_references | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v7 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v8 |
| ef:activity/change/20260821T1122181958110000/243203 | skos_definition | ef:agent/enrich_references | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v8 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v9 |
| ef:activity/change/20260821T1122181958110000/243204 | references | ef:agent/enrich_references | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v9 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v10 |
| ef:activity/change/20260821T1122181958110000/252929 | properties | ef:agent/rdkit_pre_consensus | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v10 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v11 |
| ef:activity/change/20260821T1122181958110000/260435 | altLabel | ef:agent/consensus_match | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v11 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v12 |
| ef:activity/change/20260821T1122181958110000/260436 | cas_match_labels | ef:agent/consensus_match | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v12 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v13 |
| ef:activity/change/20260821T1122181958110000/278131 | properties | ef:agent/opsin_iupac | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v13 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v14 |
| ef:activity/change/20260821T1122181958110000/284870 | properties | ef:agent/rdkit_post_consensus | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v14 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v15 |
| ef:activity/change/20260821T1122181958110000/290719 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v15 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v16 |
| ef:activity/change/20260821T1122181958110000/371421 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v16 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v17 |
| ef:activity/change/20260821T1122181958110000/392487 | properties | ef:agent/normalise_property_values | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v17 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v18 |
| ef:activity/change/20260821T1122181958110000/400989 | types | ef:agent/link_flows_to_their_substance | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v18 | ef:flow/dbbc2a4e-0b5b-44dd-b792-46d30f22e9a6/v19 |