Α,α-dimethyl-ethyl Ester Benzeneacetic Acid
Everything that changed this substance, across every flow that resolves to it. Back to the substance
fo-6938eb56488f8898
Changes
55| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 14,442 | bootstrap_labels | prefLabel | — | [{"@value":"α,α-dimethyl-ethyl ester benzeneacetic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_la… | Bootstrapped prefLabel from legacy name field |
| 14,443 | bootstrap_labels | name | α,α-dimethyl-ethyl ester benzeneacetic acid | — | Purged legacy name field to enforce prefLabel usage |
| 14,444 | bootstrap_labels | synonyms | ["organic","benzeneaceticacid,î±,î±-dimethyl-,ethylester","dimethylphenylaceticacidethylester","edmpa"] | [] | Removed legacy synonyms field in favor of structured labels |
| 49,331 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Surface water"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 49,332 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-suwa | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 60,915 | 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) |
| 60,916 | 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) |
| 99,959 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 99,960 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 108,755 | 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 |
| 108,756 | 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 |
| 115,341 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 115,342 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-agri | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 123,439 | 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 |
| 123,440 | 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 |
| 126,005 | 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 |
| 126,006 | 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 |
| 131,659 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 131,660 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 135,069 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Ocean"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 135,070 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-ocea | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 174,049 | 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 |
| 174,050 | 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 |
| 176,299 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Aircraft cruise height"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 176,300 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-aicrhe | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 180,133 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Ground level","population_density":"Urban (>1000 people/square mil… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 180,134 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 186,243 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Medium stack, <150 meters","population_density":"Rural (<1000 peop… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 186,244 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-mest15me-ru10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 218,109 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,437 | normalize_name_case | prefLabel | [{"@value":"α,α-dimethyl-ethyl ester benzeneacetic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_la… | [{"@value":"Α,α-dimethyl-ethyl Ester Benzeneacetic Acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_la… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 240,857 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H16O2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 240,858 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 240,859 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J559.586J","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['2901-13-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[232036, 6436767, 22372823, 46835344]; selected_pubchem_cids=[232036]; 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 |
| 252,261 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H16O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H16O2"]… | rdkit_pre_consensus from 'CCOC(=O)C(C)(C)C1=CC=CC=C1'; added: molecular_mass, monoisotopic_mass |
| 273,407 | consensus_match | altLabel | [] | [{"@value":"Benzeneacetic acid, α,α-dimethyl-, ethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus… | group_key=α,α-dimethyl-ethylesterbenzeneaceticacid||dimension=Environmental > media=Water > water_body=Surface water; cas=2901-13-5; added Common Chemistry CAS names as altLabel: Benzeneacetic acid, α,α-dimethyl-, ethyl ester, Ethyl 2-methyl-2-phenylpropanoate, Ethyl 2-methyl-2-phenylpropionate, Ethyl 2-phenylisobutyrate, Ethyl dimethylphenylacetate, Ethyl α,α-dimethylbenzeneacetate, Ethyl α,α-dimethylphenylacetate, Hydratropic acid, α-methyl-, ethyl ester, NSC 29060; object_uuid=fo-6938eb56488f8898 |
| 273,408 | consensus_match | cas_match_labels | — | {"2901-13-5":"exactMatch"} | group_key=α,α-dimethyl-ethylesterbenzeneaceticacid||dimension=Environmental > media=Water > water_body=Surface water; group_sources=[]; cas_sources={'2901-13-5': []}; assigned CAS labels from group consensus; object_uuid=fo-6938eb56488f8898: {'2901-13-5': 'exactMatch'} |
| 277,455 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H16O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H16O2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Benzeneacetic acid, α,α-dimethyl-, ethyl ester' |
| 284,140 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H16O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H16O2"]… | rdkit_post_consensus from 'CCOC(=O)C(C)(C)c1ccccc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,225 | strip_catalogue_altlabels | altLabel | [{"@value":"Benzeneacetic acid, α,α-dimethyl-, ethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus… | [{"@value":"Benzeneacetic acid, α,α-dimethyl-, ethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus… | Removed 1 catalogue altLabel value(s): 'NSC 29060' (registry code) |
| 305,731 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/143d77ee-77b1-… | associations resolved on the elementary layer |
| 311,515 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/249b11e5-da40-… | associations resolved on the elementary layer |
| 331,013 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/54485a42-1dcb-… | associations resolved on the elementary layer |
| 335,411 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/6360b546-3a0a-… | associations resolved on the elementary layer |
| 338,704 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/6e118492-09db-… | associations resolved on the elementary layer |
| 342,752 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/7bfee5db-dcbf-… | associations resolved on the elementary layer |
| 344,039 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/803353ee-afa7-… | associations resolved on the elementary layer |
| 346,864 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/89dc4416-9f17-… | associations resolved on the elementary layer |
| 348,565 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/8f7e70ae-3b45-… | associations resolved on the elementary layer |
| 368,078 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/d1b9b964-d38b-… | associations resolved on the elementary layer |