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4-Cyanopyridine

UUID add1dedc-bd95-4ebc-b3c8-13227140b286
Deprecated yes
Replaced By 57869472-3e56-4339-93e9-bcebc3d6483e
Flow Object IDfo-758afd970b9f7813
Source EF 3.1
Context Environmental → Ground → Unknown
CAS Numbers 100-48-1
EC Numbers 202-856-2
prefLabel ⓘ
Language Value Provenance
en 4-Cyanopyridine
altLabel ⓘ
Language Value Provenance
en 4-azabenzonitrile
en 4-nitrilopyridine
en 4-pyridinecarbonitrile
en 4-pyridinenitrile
en 4-pyridyl cyanide
en 4-pyridylcarbonitrile
en gamma-cyanopyridine
en isonicotinic acid nitrile
en pyridine-4-carbonitrile
en Isonicotinonitrile
en NSC 60681
en γ-Cyanopyridine
Definitions
Language Value Provenance
en A cyanopyridine carrying the cyano group at position 4.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey GPHQHTOMRSGBNZ-UHFFFAOYSA-N
InChI InChI=1S/C6H4N2/c7-5-6-1-3-8-4-2-6/h1-4H
IUPAC name 4-pyridinecarbonitrile, isonicotinonitrile, pyridine-4-carbonitrile
Molecular formula C6H4N2
Molecular mass 104.112
Monoisotopic mass 104.03745
SMILES C1=CN=CC=C1C#N, N#Cc1ccncc1

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 add1dedc-bd95-4ebc-b3c8-13227140b286 isonicotinonitrile

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=isonicotinonitrile||dimension=Environmental > media=Water > water_body=Unknown; cas=100-48-1; added Common Chemistry CAS names as altLabel: Isonicotinonitrile, NSC 60681, γ-Cyanopyridine; object_uuid=fo-758afd970b9f7813
cas_match_labels 1 — consensus_match group_key=isonicotinonitrile||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'100-48-1': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-758afd970b9f7813: {'100-48-1': 'exactMatch'}
prefLabel 1 — consensus_match cas=100-48-1; cc_chebi_agreed_name='4-Cyanopyridine'; object_uuid=fo-758afd970b9f7813

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

Consensus Changes

Field Old Value New Value Comment
prefLabel [{'@value': 'Isonicotinonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'bootstrap_labels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'legacy name field'}}] [{'@value': '4-Cyanopyridine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:100-48-1'], 'prov:wasDerivedFrom': 'Common Chemistry / ChEBI primary name agreement'}}] cas=100-48-1; cc_chebi_agreed_name='4-Cyanopyridine'; object_uuid=fo-758afd970b9f7813
altLabel [{'@value': '4-azabenzonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-azabenzonitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-cyanopyridine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-cyanopyridine', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-nitrilopyridine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-nitrilopyridine', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-pyridinecarbonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-pyridinecarbonitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-pyridinenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-pyridinenitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-pyridyl cyanide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-pyridyl cyanide', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-pyridylcarbonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-pyridylcarbonitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'gamma-cyanopyridine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:gamma-cyanopyridine', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'isonicotinic acid nitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:isonicotinic acid nitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'pyridine-4-carbonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:pyridine-4-carbonitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '4-azabenzonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-azabenzonitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-nitrilopyridine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-nitrilopyridine', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-pyridinecarbonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-pyridinecarbonitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-pyridinenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-pyridinenitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-pyridyl cyanide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-pyridyl cyanide', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-pyridylcarbonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-pyridylcarbonitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'gamma-cyanopyridine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:gamma-cyanopyridine', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'isonicotinic acid nitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:isonicotinic acid nitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'pyridine-4-carbonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:pyridine-4-carbonitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Isonicotinonitrile', '@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=100-48-1; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-758afd970b9f7813
altLabel [{'@value': '4-azabenzonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-azabenzonitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-nitrilopyridine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-nitrilopyridine', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-pyridinecarbonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-pyridinecarbonitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-pyridinenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-pyridinenitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-pyridyl cyanide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-pyridyl cyanide', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-pyridylcarbonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-pyridylcarbonitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'gamma-cyanopyridine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:gamma-cyanopyridine', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'isonicotinic acid nitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:isonicotinic acid nitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'pyridine-4-carbonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:pyridine-4-carbonitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Isonicotinonitrile', '@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': '4-azabenzonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-azabenzonitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-nitrilopyridine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-nitrilopyridine', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-pyridinecarbonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-pyridinecarbonitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-pyridinenitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-pyridinenitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-pyridyl cyanide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-pyridyl cyanide', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-pyridylcarbonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-pyridylcarbonitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'gamma-cyanopyridine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:gamma-cyanopyridine', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'isonicotinic acid nitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:isonicotinic acid nitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'pyridine-4-carbonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:pyridine-4-carbonitrile', 'http://purl.obolibrary.org/obo/CHEBI_28020', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Isonicotinonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:100-48-1', 'https://commonchemistry.cas.org/detail?cas_rn=100-48-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 60681', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:100-48-1', 'https://commonchemistry.cas.org/detail?cas_rn=100-48-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'γ-Cyanopyridine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:100-48-1', 'https://commonchemistry.cas.org/detail?cas_rn=100-48-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=isonicotinonitrile||dimension=Environmental > media=Water > water_body=Unknown; cas=100-48-1; added Common Chemistry CAS names as altLabel: Isonicotinonitrile, NSC 60681, γ-Cyanopyridine; object_uuid=fo-758afd970b9f7813
cas_match_labels None {'100-48-1': 'exactMatch'} group_key=isonicotinonitrile||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'100-48-1': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-758afd970b9f7813: {'100-48-1': '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": [
    "100-48-1"
  ],
  "ec_numbers": [
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  ],
  "context": {
    "dimension": "Environmental",
    "media": "Ground",
    "geography": "Unknown"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [
    {
      "method_uuid": "05316e7a-b254-4bea-9cf0-6bf33eb5c630",
      "name": "Ecotoxicity, freshwater",
      "methodology": "Environmental Footprint",
      "impact_category": "Aquatic eco-toxicity",
      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 25.866
    },
    {
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      "name": "Ecotoxicity, freshwater_organics",
      "methodology": "Environmental Footprint",
      "impact_category": "Aquatic eco-toxicity",
      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 25.866
    }
  ],
  "source": "EF 3.1",
  "identifier": "add1dedc-bd95-4ebc-b3c8-13227140b286",
  "input_datasets": [
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      "source_flow_name": "isonicotinonitrile",
      "source_metadata": {
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        "input_dataset": "EF 3.1",
        "original_context": [
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          "Emissions to soil",
          "Emissions to soil, unspecified"
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      }
    }
  ],
  "prefLabel": [
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  "_sources": {
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    "skos:definition": "enrich_references",
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  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-grou-unkn",
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  "properties": {
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      "rdfs:label": "SMILES",
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    "https://w3id.org/chemrof/inchi2d_string": {
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    "https://w3id.org/chemrof/inchi2d_key_string": {
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      "@value": [
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      "rdfs:label": "InChIKey",
      "provenance": [
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