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Oleonitrile

UUID 9a979b71-31b6-4fc4-b0e9-10841a88c172
Flow Object IDfo-8614378412d02fb7
Source EF 3.1
Context Environmental → Water → Ocean
CAS Numbers 112-91-4
EC Numbers 204-016-0
prefLabel ⓘ
Language Value Provenance
en Oleonitrile
altLabel ⓘ
Language Value Provenance
en (9Z)-octadec-9-enenitrile
en (Z)-9-Octadecenenitrile
en (Z)-octadec-9-enenitrile
en Oleic acid nitrile
en Oleic nitrile
en Oleoylnitrile
en Oleyl nitrile
en Oleylonitrile
en cis-9-octadecenenitrile
en (9<em>Z</em>)-9-Octadecenenitrile
en 9-Octadecenenitrile, (9<em>Z</em>)-
en 9-Octadecenenitrile, (<em>Z</em>)-
en Arneel O
Definitions
Language Value Provenance
en A fatty nitrile obtained by formal condensation of oleic acid with ammonia.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey UIAMCVSNZQYIQS-KTKRTIGZSA-N
InChI InChI=1S/C18H33N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h9-10H,2-8,11-17H2,1H3/b10-9-
IUPAC name (Z)-9-octadecenenitrile, (Z)-octadec-9-enenitrile
Molecular formula C18H33N
Molecular mass 263.469
Monoisotopic mass 263.2613
SMILES CCCCCCCC/C=CCCCCCCCC#N, CCCCCCCC/C=C\CCCCCCCC#N, CCCCCCCCC=CCCCCCCCC#N

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 9a979b71-31b6-4fc4-b0e9-10841a88c172 (9e)-octadec-9-enenitrile

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 (9e)-octadec-9-enenitrile Emissions/Emissions to water/Emissions to sea water kg exactMatch —

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 2 — consensus_match group_key=(9e)-octadec-9-enenitrile||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=112-91-4; added Common Chemistry CAS names as altLabel: (9<em>Z</em>)-9-Octadecenenitrile, 9-Octadecenenitrile, (9<em>Z</em>)-, 9-Octadecenenitrile, (<em>Z</em>)-, Arneel O; object_uuid=fo-8614378412d02fb7
cas_match_labels 1 — consensus_match group_key=(9e)-octadec-9-enenitrile||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory']; cas_sources={'112-91-4': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-8614378412d02fb7: {'112-91-4': 'exactMatch'}
prefLabel 1 — consensus_match cas=112-91-4; cc_chebi_agreed_name='Oleonitrile'; object_uuid=fo-8614378412d02fb7

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyOcean

Consensus Changes

Field Old Value New Value Comment
prefLabel [{'@value': '(9e)-octadec-9-enenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'bootstrap_labels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'legacy name field'}}] [{'@value': 'Oleonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:112-91-4'], 'prov:wasDerivedFrom': 'Common Chemistry / ChEBI primary name agreement'}}] cas=112-91-4; cc_chebi_agreed_name='Oleonitrile'; object_uuid=fo-8614378412d02fb7
altLabel [{'@value': '(9Z)-octadec-9-enenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(9Z)-octadec-9-enenitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(Z)-9-Octadecenenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(Z)-9-Octadecenenitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(Z)-octadec-9-enenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(Z)-octadec-9-enenitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleic acid nitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleic acid nitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleic nitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleic nitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleoylnitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleoylnitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleyl nitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleyl nitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleylonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleylonitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'cis-9-octadecenenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:cis-9-octadecenenitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '(9Z)-octadec-9-enenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(9Z)-octadec-9-enenitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(Z)-9-Octadecenenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(Z)-9-Octadecenenitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(Z)-octadec-9-enenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(Z)-octadec-9-enenitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleic acid nitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleic acid nitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleic nitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleic nitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleoylnitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleoylnitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleyl nitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleyl nitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleylonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleylonitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'cis-9-octadecenenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:cis-9-octadecenenitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(9e)-octadec-9-enenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] cas=112-91-4; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-8614378412d02fb7
altLabel [{'@value': '(9Z)-octadec-9-enenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(9Z)-octadec-9-enenitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(Z)-9-Octadecenenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(Z)-9-Octadecenenitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(Z)-octadec-9-enenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(Z)-octadec-9-enenitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleic acid nitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleic acid nitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleic nitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleic nitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleoylnitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleoylnitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleyl nitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleyl nitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleylonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleylonitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'cis-9-octadecenenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:cis-9-octadecenenitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(9e)-octadec-9-enenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] [{'@value': '(9Z)-octadec-9-enenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(9Z)-octadec-9-enenitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(Z)-9-Octadecenenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(Z)-9-Octadecenenitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(Z)-octadec-9-enenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(Z)-octadec-9-enenitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleic acid nitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleic acid nitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleic nitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleic nitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleoylnitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleoylnitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleyl nitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleyl nitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Oleylonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Oleylonitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'cis-9-octadecenenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:cis-9-octadecenenitrile', 'http://purl.obolibrary.org/obo/CHEBI_133637', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(9<em>Z</em>)-9-Octadecenenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:112-91-4', 'https://commonchemistry.cas.org/detail?cas_rn=112-91-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '9-Octadecenenitrile, (9<em>Z</em>)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:112-91-4', 'https://commonchemistry.cas.org/detail?cas_rn=112-91-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '9-Octadecenenitrile, (<em>Z</em>)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:112-91-4', 'https://commonchemistry.cas.org/detail?cas_rn=112-91-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Arneel O', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:112-91-4', 'https://commonchemistry.cas.org/detail?cas_rn=112-91-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=(9e)-octadec-9-enenitrile||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=112-91-4; added Common Chemistry CAS names as altLabel: (9<em>Z</em>)-9-Octadecenenitrile, 9-Octadecenenitrile, (9<em>Z</em>)-, 9-Octadecenenitrile, (<em>Z</em>)-, Arneel O; object_uuid=fo-8614378412d02fb7
cas_match_labels None {'112-91-4': 'exactMatch'} group_key=(9e)-octadec-9-enenitrile||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory']; cas_sources={'112-91-4': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-8614378412d02fb7: {'112-91-4': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
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  "name": null,
  "cas_numbers": [
    "112-91-4"
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  "ec_numbers": [
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  "context": {
    "dimension": "Environmental",
    "media": "Water",
    "water_body": "Ocean"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [
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      "characterization_factor": 1.1183
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      "name": "Human toxicity, non-cancer",
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      "impact_category": "Non-cancer human health effects",
      "impact_indicator": "Comparative Toxic Unit for human (CTUh)",
      "characterization_factor": 5.1384e-7
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    {
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      "characterization_factor": 5.1384e-7
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      "methodology": "Environmental Footprint",
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      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 1.1183
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  ],
  "source": "EF 3.1",
  "identifier": "9a979b71-31b6-4fc4-b0e9-10841a88c172",
  "input_datasets": [
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      "source_metadata": {
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  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-wate-ocea",
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  "properties": {
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      "rdfs:label": "Molecular formula",
      "provenance": [
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    "https://w3id.org/chemrof/smiles_string": {
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      "@value": [
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      "rdfs:label": "SMILES",
      "provenance": [
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