Sodium Dodecane-1-sulphonate
Everything that changed this substance, across every flow that resolves to it. Back to the substance
fo-af391269f4641831
Changes
56| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 9,921 | bootstrap_labels | prefLabel | — | [{"@value":"sodium dodecane-1-sulphonate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:was… | Bootstrapped prefLabel from legacy name field |
| 9,922 | bootstrap_labels | name | sodium dodecane-1-sulphonate | — | Purged legacy name field to enforce prefLabel usage |
| 9,923 | bootstrap_labels | synonyms | ["1-DODECANESULFONIC ACID","1-Dodecanesulfonic acid, ion(1-)","AC1L25CW","Benzenemethanaminium, N-(C12-C16-alkyl)-N,N-d… | [] | Removed legacy synonyms field in favor of structured labels |
| 22,447 | bootstrap_labels | synonyms | ["sodiumdodecane-1-sulphonate","sodiumdodecane-1-sulfonate","1-DODECANESULFONIC ACID","1-Dodecanesulfonic acid, ion(1-)… | [] | Removed legacy synonyms field in favor of structured labels |
| 42,552 | 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 |
| 42,553 | 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 |
| 54,472 | 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) |
| 54,473 | 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) |
| 87,154 | 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 |
| 87,155 | 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 |
| 98,512 | 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 |
| 98,513 | 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 |
| 100,388 | 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 |
| 100,389 | 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 |
| 108,992 | 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 |
| 108,993 | 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 |
| 116,834 | 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 |
| 116,835 | 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 |
| 120,406 | 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 |
| 120,407 | 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 |
| 123,332 | 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 |
| 123,333 | 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 |
| 125,344 | 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 |
| 125,345 | 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 |
| 153,466 | 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 |
| 153,467 | 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 |
| 153,470 | 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) |
| 153,471 | 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) |
| 155,906 | 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 |
| 155,907 | 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 |
| 216,635 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,413 | normalize_name_case | prefLabel | [{"@value":"sodium dodecane-1-sulphonate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:was… | [{"@value":"Sodium Dodecane-1-sulphonate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:was… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 236,655 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H26NaO3… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 236,656 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 236,657 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=2386-53-0","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['2386-53-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[923, 5360545, 23665726, 87060252]; selected_pubchem_cids=[87060252]; 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 |
| 251,042 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H26NaO3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H26NaO3… | rdkit_pre_consensus from 'CCCCCCCCCCCCS(=O)(=O)O.[Na]'; added: molecular_mass, monoisotopic_mass |
| 271,901 | consensus_match | altLabel | [] | [{"@value":"1-Dodecanesulfonic acid, sodium salt","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","p… | group_key=sodiumdodecane-1-sulphonate||dimension=Environmental > media=Air > strata=Unknown; cas=2386-53-0; added Common Chemistry CAS names as altLabel: 1-Dodecanesulfonic acid, sodium salt, 1-Dodecanesulfonic acid, sodium salt (1:1), <em>n</em>-Dodecylsulfonic acid sodium salt, AS, Acme SLS, CP 20, CP 20 (emulsifier), Calsoft SLS 30, DSS, Dodecanesulfonic acid, sodium salt, Dodecyl sodium sulfonate, Dodecylsulfonic acid sodium salt, Emal 2FG, H 95, Laurylsulfonic acid sodium salt, P 30, P 30 (surfactant), Perlan Alb, Sodium 1-dodecanesulfonate, Sodium <em>n</em>-dodecylsulfonate, Sodium dodecanesulfonate, Sodium dodecylsulfonate, Sodium laurylsulfonate, Stepanol PCK; object_uuid=fo-af391269f4641831 |
| 271,902 | consensus_match | cas_match_labels | — | {"2386-53-0":"exactMatch"} | group_key=sodiumdodecane-1-sulphonate||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'2386-53-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-af391269f4641831: {'2386-53-0': 'exactMatch'} |
| 276,228 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H26NaO3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H26NaO3… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Sodium Dodecane-1-sulphonate' |
| 282,813 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H26NaO3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H25NaO3… | rdkit_post_consensus from 'CCCCCCCCCCCCS(=O)(=O)[O-].[Na+]'; added: inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass; confirmed: smiles_string, inchi2d_string |
| 286,924 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H25NaO3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H25NaO3… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 289,332 | strip_catalogue_altlabels | altLabel | [{"@value":"1-Dodecanesulfonic acid, sodium salt","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","p… | [{"@value":"1-Dodecanesulfonic acid, sodium salt","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","p… | Removed 5 catalogue altLabel value(s): 'CP 20' (grade code), 'CP 20 (emulsifier)' (grade code), 'H 95' (grade code), 'P 30' (grade code), 'P 30 (surfactant)' (grade code) |
| 302,301 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/0a27e297-652f-… | associations resolved on the elementary layer |
| 308,263 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/1b427e00-11bc-… | associations resolved on the elementary layer |
| 324,593 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/4d62e027-6d3a-… | associations resolved on the elementary layer |
| 330,254 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/51ba7d45-39c4-… | associations resolved on the elementary layer |
| 331,191 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/5506247d-912c-… | associations resolved on the elementary layer |
| 335,494 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/63d89db2-3211-… | associations resolved on the elementary layer |
| 339,416 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/70998ef5-678b-… | associations resolved on the elementary layer |
| 341,201 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/769b338f-1a85-… | associations resolved on the elementary layer |