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3,9-diethylundecane

Flow Object IDfo-adb8d4ba3bf0ef94
TypeConsensus
prefLabel
Label Language
3,9-diethylundecane en
CAS Numbers13286-72-1
Changes Applied12

Properties

Predicate Value
InChIKey FGJCHUDLLJCOIT-UHFFFAOYSA-N
InChI InChI=1S/C15H32/c1-5-14(6-2)12-10-9-11-13-15(7-3)8-4/h14-15H,5-13H2,1-4H3
IUPAC name 3,9-diethylundecane
Molecular formula C15H32
SMILES CCC(CC)CCCCCC(CC)CC

References

Linked Elementary Flows

UUID Source Unit Context LCIA Factors Consensus Changes
2906629a… EF 3.1 kg Environmental → Air → Aircraft cruise height 0 1
4d9a8790… EF 3.1 kg Environmental → Air → Ground level → Rural (<1000 people/square mile) 0 1
4d9a8790… EF 3.1 kg Environmental → Air → Ground level → Urban (>1000 people/square mile) 0 1
4d9a8790… EF 3.1 kg Environmental → Air → High stack, >150 meters 0 1
4d9a8790… EF 3.1 kg Environmental → Air → Unknown 0 1
29066298… EF 3.1 kg Environmental → Ground → Agricultural 0 1
29068970… EF 3.1 kg Environmental → Ground → Unknown 0 1
29068971… EF 3.1 kg Environmental → Water → Ocean 0 1
29066299… EF 3.1 kg Environmental → Water → Surface water 0 1
29068973… EF 3.1 kg Environmental → Water → Unknown 0 1
▶

Changes Applied
Elementary Flow Field Old Value New Value Comment
29066298… cas_match_labels — {"13286-72-1":"exactMatch"} group_key=3,9-diethylundecane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'13286-72-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-adb8d4ba3bf0ef94: {'13286-72-1': 'exactMatch'}
29066299… cas_match_labels — {"13286-72-1":"exactMatch"} group_key=3,9-diethylundecane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'13286-72-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-adb8d4ba3bf0ef94: {'13286-72-1': 'exactMatch'}
2906629a… cas_match_labels — {"13286-72-1":"exactMatch"} group_key=3,9-diethylundecane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'13286-72-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-adb8d4ba3bf0ef94: {'13286-72-1': 'exactMatch'}
29068970… cas_match_labels — {"13286-72-1":"exactMatch"} group_key=3,9-diethylundecane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'13286-72-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-adb8d4ba3bf0ef94: {'13286-72-1': 'exactMatch'}
29068971… cas_match_labels — {"13286-72-1":"exactMatch"} group_key=3,9-diethylundecane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'13286-72-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-adb8d4ba3bf0ef94: {'13286-72-1': 'exactMatch'}
29068972… cas_match_labels — {"13286-72-1":"exactMatch"} group_key=3,9-diethylundecane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'13286-72-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-adb8d4ba3bf0ef94: {'13286-72-1': 'exactMatch'}
29068973… cas_match_labels — {"13286-72-1":"exactMatch"} group_key=3,9-diethylundecane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'13286-72-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-adb8d4ba3bf0ef94: {'13286-72-1': 'exactMatch'}
29068974… cas_match_labels — {"13286-72-1":"exactMatch"} group_key=3,9-diethylundecane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'13286-72-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-adb8d4ba3bf0ef94: {'13286-72-1': 'exactMatch'}
4d9a8790… cas_match_labels — {"13286-72-1":"exactMatch"} group_key=3,9-diethylundecane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'13286-72-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-adb8d4ba3bf0ef94: {'13286-72-1': 'exactMatch'}
4d9a8790… cas_match_labels — {"13286-72-1":"exactMatch"} group_key=3,9-diethylundecane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'13286-72-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-adb8d4ba3bf0ef94: {'13286-72-1': 'exactMatch'}
4d9a8790… cas_match_labels — {"13286-72-1":"exactMatch"} group_key=3,9-diethylundecane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'13286-72-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-adb8d4ba3bf0ef94: {'13286-72-1': 'exactMatch'}
4d9a8790… cas_match_labels — {"13286-72-1":"exactMatch"} group_key=3,9-diethylundecane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'13286-72-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-adb8d4ba3bf0ef94: {'13286-72-1': 'exactMatch'}

Flow Object JSON

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  "flow_object_id": "fo-adb8d4ba3bf0ef94",
  "prefLabel": [
    {
      "@value": "3,9-diethylundecane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "prefLabel"
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    }
  ],
  "altLabel": [],
  "properties": {
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      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C15H32"
      ],
      "rdfs:label": "Molecular formula",
      "provenance": {
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        "prov:hadPrimarySource": [
          "CID:129656744"
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        "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
      }
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "FGJCHUDLLJCOIT-UHFFFAOYSA-N"
      ],
      "rdfs:label": "InChIKey",
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        "prov:wasDerivedFrom": "pubchem.props.InChIKey"
      }
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
        "CCC(CC)CCCCCC(CC)CC"
      ],
      "rdfs:label": "SMILES",
      "provenance": {
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        "prov:wasDerivedFrom": "pubchem.props.SMILES"
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    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
        "InChI=1S/C15H32/c1-5-14(6-2)12-10-9-11-13-15(7-3)8-4/h14-15H,5-13H2,1-4H3"
      ],
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        "prov:wasDerivedFrom": "pubchem.props.InChI"
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
        "3,9-diethylundecane"
      ],
      "rdfs:label": "IUPAC name",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        "prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
      }
    }
  },
  "references": [
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=13286-72-1",
      "provenance": {
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        "prov:wasDerivedFrom": "cas_numbers"
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    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID40897350",
      "provenance": {
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        "prov:wasDerivedFrom": "pubchem.identifiers[13286-72-1]"
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    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/129656744",
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        "prov:wasDerivedFrom": "pubchem.by_cas[13286-72-1]"
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    },
    {
      "@id": "https://www.wikidata.org/wiki/Q82873317",
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        "prov:wasDerivedFrom": "pubchem.identifiers[13286-72-1]"
      }
    }
  ],
  "created_from": {
    "resolver": "hybrid_name_cas_v1",
    "seed_uuid": "29066298-6556-11dd-ad8b-0800200c9a66",
    "seed_source": "EF 3.1"
  },
  "classifications": {
    "http://semanticscience.org/resource/CHEMINF_000446": {
      "@value": [
        "13286-72-1"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=13286-72-1"
      ],
      "skos:exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=13286-72-1"
        }
      ],
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
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  },
  "origin_qualifier": null,
  "parent_flow_object_id": null
}