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2-Dodecanone

UUID ecb8c9b8-97b4-4e1f-8400-29aea751d570
Flow Object IDfo-e4a2c0066b415ea8
Source EF 3.1
Context Environmental → Air → Unknown
CAS Numbers 6175-49-1
EC Numbers 228-222-5
prefLabel ⓘ
Language Value Provenance
en 2-Dodecanone
altLabel ⓘ
Language Value Provenance
en 12-(2,3-Dihydroxycyclopentyl)-2-dodecanone
en 2,3-Epoxypropyl Methanesulphonate
en Decyl methyl ketone
en Dodecanone-(2)
en Methyl decyl ketone
en N-Decyl methyl ketone
en Dodecan-2-one
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey LSKONYYRONEBKA-UHFFFAOYSA-N
InChI InChI=1S/C12H24O/c1-3-4-5-6-7-8-9-10-11-12(2)13/h3-11H2,1-2H3
IUPAC name 2-dodecanone, dodecan-2-one
Molecular formula C12H24O
Molecular mass 184.323
Monoisotopic mass 184.18272
SMILES CCCCCCCCCCC(=O)C, CCCCCCCCCCC(C)=O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 ecb8c9b8-97b4-4e1f-8400-29aea751d570 dodecan-2-one

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 dodecan-2-one Emissions/Emissions to air/Emissions to air, indoor kg exactMatch —

Consolidated Field Provenance

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

Field Change Count Latest Time Transformers Latest Comment
altLabel 1 — consensus_match cas=6175-49-1; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-e4a2c0066b415ea8
cas_match_labels 1 — consensus_match group_key=dodecan-2-one||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'6175-49-1': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e4a2c0066b415ea8: {'6175-49-1': 'exactMatch'}
prefLabel 1 — consensus_match cas=6175-49-1; cc_chebi_agreed_name='2-Dodecanone'; object_uuid=fo-e4a2c0066b415ea8

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
indoorUnknown

Consensus Changes

Field Old Value New Value Comment
prefLabel [{'@value': 'Dodecan-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'bootstrap_labels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'legacy name field'}}] [{'@value': '2-Dodecanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6175-49-1'], 'prov:wasDerivedFrom': 'Common Chemistry / ChEBI primary name agreement'}}] cas=6175-49-1; cc_chebi_agreed_name='2-Dodecanone'; object_uuid=fo-e4a2c0066b415ea8
altLabel [{'@value': '12-(2,3-Dihydroxycyclopentyl)-2-dodecanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:12-(2,3-Dihydroxycyclopentyl)-2-dodecanone', 'http://purl.obolibrary.org/obo/CHEBI_89284', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,3-Epoxypropyl Methanesulphonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,3-Epoxypropyl Methanesulphonate', 'http://purl.obolibrary.org/obo/CHEBI_89284', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Decyl methyl ketone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Decyl methyl ketone', 'http://purl.obolibrary.org/obo/CHEBI_89284', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Dodecanone-(2)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Dodecanone-(2)', 'http://purl.obolibrary.org/obo/CHEBI_89284', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Methyl decyl ketone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Methyl decyl ketone', 'http://purl.obolibrary.org/obo/CHEBI_89284', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'N-Decyl methyl ketone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:N-Decyl methyl ketone', 'http://purl.obolibrary.org/obo/CHEBI_89284', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '12-(2,3-Dihydroxycyclopentyl)-2-dodecanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:12-(2,3-Dihydroxycyclopentyl)-2-dodecanone', 'http://purl.obolibrary.org/obo/CHEBI_89284', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,3-Epoxypropyl Methanesulphonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,3-Epoxypropyl Methanesulphonate', 'http://purl.obolibrary.org/obo/CHEBI_89284', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Decyl methyl ketone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Decyl methyl ketone', 'http://purl.obolibrary.org/obo/CHEBI_89284', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Dodecanone-(2)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Dodecanone-(2)', 'http://purl.obolibrary.org/obo/CHEBI_89284', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Methyl decyl ketone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Methyl decyl ketone', 'http://purl.obolibrary.org/obo/CHEBI_89284', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'N-Decyl methyl ketone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:N-Decyl methyl ketone', 'http://purl.obolibrary.org/obo/CHEBI_89284', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Dodecan-2-one', '@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=6175-49-1; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-e4a2c0066b415ea8
cas_match_labels None {'6175-49-1': 'exactMatch'} group_key=dodecan-2-one||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'6175-49-1': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e4a2c0066b415ea8: {'6175-49-1': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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  "general_comment": null,
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  "unit": "kg",
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      "characterization_factor": 18.845
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        "prov:hadPrimarySource": [
          "http://purl.obolibrary.org/obo/CHEBI_89284"
        ],
        "prov:wasDerivedFrom": "chebi.xrefs_urls"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "12-(2,3-Dihydroxycyclopentyl)-2-dodecanone",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "http://purl.obolibrary.org/obo/CHEBI_89284",
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "2,3-Epoxypropyl Methanesulphonate",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "http://purl.obolibrary.org/obo/CHEBI_89284",
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Decyl methyl ketone",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Dodecanone-(2)",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Methyl decyl ketone",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "http://purl.obolibrary.org/obo/CHEBI_89284",
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "N-Decyl methyl ketone",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "http://purl.obolibrary.org/obo/CHEBI_89284",
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Dodecan-2-one",
      "@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_match_labels": {
    "6175-49-1": "exactMatch"
  },
  "concept_associations": [
    {
      "@type": "xkos:ConceptAssociation",
      "xkos:sourceConcept": {
        "@id": "https://vocab.brightway.one/ef/3.1/flow/ecb8c9b8-97b4-4e1f-8400-29aea751d570",
        "skos:prefLabel": "dodecan-2-one",
        "context": "Emissions/Emissions to air/Emissions to air, indoor",
        "qudt:unit": "kg"
      },
      "xkos:targetConcept": {
        "@id": "https://vocab.brightway.dev/elementary-flows/ecb8c9b8-97b4-4e1f-8400-29aea751d570"
      },
      "xkos:mapType": {
        "@id": "http://www.w3.org/2004/02/skos/core#exactMatch"
      },
      "provenance": {
        "prov:wasGeneratedBy": "build_concept_associations",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "https://eplca.jrc.ec.europa.eu/permalink/EF3_1/EF-v3.1.zip"
        ]
      }
    }
  ],
  "flow_object_id": "fo-e4a2c0066b415ea8"
}