Consensus flow list

Identity

Type
Neutral molecule
CAS
10339-55-6
EC
233-732-6
Origin
EF 3.1 hybrid_name_cas_v1
Changes
53 across every transformer

Structure

Structure diagram for 3,7-dimethylnona-1,6-dien-3-ol

Alternative labels

4

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string KRLBLPBPZSSIGH-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C11H20O/c1-5-10(3)8-7-9-11(4,12)6-2/h6,8,12H,2,5,7,9H2,1,3-4H3
IUPAC name chemrof:IUPAC_name 3,7-dimethylnona-1,6-dien-3-ol
Molecular formula chemrof:molecular_formula C11H20O
Molecular mass chemrof:molecular_mass 168.28
Monoisotopic mass chemrof:monoisotopic_mass 168.151415
SMILES string chemrof:smiles_string C=CC(C)(O)CCC=C(C)CC

Known URLs

4

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=10339-55-6 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.030.653 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/25185 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q126677908 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
e3ec97dc-49f5-473f-8ee1-4e8772ead6db Environmental → Air → Aircraft cruise height EF 3.1 kg 4
f796b3bb-0fb6-40a0-92af-d957a0b1007b Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
0aa49a63-7df2-4a00-a390-3e3be93549f0 Environmental → Air → Indoor EF 3.1 kg 4
e003e2fa-6c21-417a-ab58-f67099934f87 Environmental → Air → Long-term EF 3.1 kg 0
3af2fa70-7802-44dd-ac58-87eb9df945d4 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
a7b65e62-a9b8-4b20-87e5-96b3a5388e6b Environmental → Air → Unknown EF 3.1 kg 4
f6345d26-da78-42b6-aff6-5ba5b9900244 Environmental → Ground → Agricultural EF 3.1 kg 4
86de65fe-92c6-4f82-8004-c384601aaabb Environmental → Ground → Non-agricultural EF 3.1 kg 4
a79d3dd2-15a4-4545-b8dc-c58a4d392a09 Environmental → Ground → Unknown EF 3.1 kg 4
62d7bef5-e157-40ef-9864-431d71dd6d45 Environmental → Water → Long-term EF 3.1 kg 0
bbefff17-0c65-4fd2-bfcd-cbbf79d940be Environmental → Water → Ocean EF 3.1 kg 4
1f7564fd-1750-402f-ac9d-00a95f91a4ef Environmental → Water → Surface water EF 3.1 kg 4
c427b8a2-bbd6-417e-83e5-34253570bb09 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (53 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-228b8d716c0162a0",
  "prefLabel": [
    {
      "@value": "3,7-dimethylnona-1,6-dien-3-ol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1,6-Nonadien-3-ol, 3,7-dimethyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=10339-55-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "3,7-Dimethyl-1,6-nonadien-3-ol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=10339-55-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Ethyl linalool",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "EF 3.1",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Methyllinalool",
      "@language": "en",
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      "provenance": {
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      "rdfs:label": "InChIKey",
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    },
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    },
    "https://w3id.org/chemrof/IUPAC_name": {
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      ],
      "provenance": {
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      },
      "attested_by": {
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    },
    "https://w3id.org/chemrof/molecular_mass": {
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      "rdfs:label": "Molecular mass",
      "@value": [
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      ],
      "provenance": [
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      ],
      "attested_by": {
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        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
      "@id": "https://w3id.org/chemrof/monoisotopic_mass",
      "rdfs:label": "Monoisotopic mass",
      "@value": [
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      ],
      "provenance": [
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      ],
      "attested_by": {
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        ]
      },
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    }
  },
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  ],
  "created_from": {
    "resolver": "hybrid_name_cas_v1",
    "seed_uuid": "0aa49a63-7df2-4a00-a390-3e3be93549f0",
    "seed_source": "EF 3.1",
    "semantic_typing": {
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      "provenance": {
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  },
  "classifications": {
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      "rdfs:seeAlso": [
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      "http://www.w3.org/2004/02/skos/core#exactMatch": [
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  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
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  ]
}

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