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Nonan-5-one

UUID f7e5501d-486a-4fd3-8af3-52deb837f23e
Flow Object IDfo-cbf7715a673728aa
Source EF 3.1
Context Environmental → Air → Ground level → Rural (<1000 people/square mile)
CAS Numbers 502-56-7
EC Numbers 207-946-5
prefLabel
Language Value Provenance
en Nonan-5-one
altLabel
Language Value Provenance
en 5-Nonanone
en Butyl ketone
en Dibutyl ketone
en NSC 14761
References
Shared Properties
Predicate Value
InChIKey QGJZLNKBHJESQX-UHFFFAOYSA-N, WSGCRAOTEDLMFQ-UHFFFAOYSA-N
InChI InChI=1S/C30H48O3/c1-18(2)19-10-15-30(25(32)33)17-16-28(6)20(24(19)30)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h19-24,31H,1,8-17H2,2-7H3,(H,32,33), InChI=1S/C9H18O/c1-3-5-7-9(10)8-6-4-2/h3-8H2,1-2H3
IUPAC name 5-nonanone, 5a,5b,8,8,11a-pentamethyl-9-oxidanyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid, 9-hydroxy-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid, 9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-(1-methylethenyl)-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid, 9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid, nonan-5-one
Molecular formula C30H48O3, C9H18O
SMILES CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C(=O)O, CCCCC(=O)CCCC

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 f7e5501d-486a-4fd3-8af3-52deb837f23e nonan-5-one

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 nonan-5-one Emissions/Emissions to air/Emissions to air, unspecified (long-term) 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 group_key=nonan-5-one||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=502-56-7; added Common Chemistry CAS names as altLabel: 5-Nonanone, Butyl ketone, Dibutyl ketone, NSC 14761; object_uuid=fo-cbf7715a673728aa
cas_match_labels 1 consensus_match group_key=nonan-5-one||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory', 'pubchem']; cas_sources={'502-56-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-cbf7715a673728aa: {'502-56-7': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataGround level
population_densityRural (<1000 people/square mile)

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '5-Nonanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:502-56-7', 'https://commonchemistry.cas.org/detail?cas_rn=502-56-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Butyl ketone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:502-56-7', 'https://commonchemistry.cas.org/detail?cas_rn=502-56-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Dibutyl ketone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:502-56-7', 'https://commonchemistry.cas.org/detail?cas_rn=502-56-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 14761', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:502-56-7', 'https://commonchemistry.cas.org/detail?cas_rn=502-56-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=nonan-5-one||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=502-56-7; added Common Chemistry CAS names as altLabel: 5-Nonanone, Butyl ketone, Dibutyl ketone, NSC 14761; object_uuid=fo-cbf7715a673728aa
cas_match_labels None {'502-56-7': 'exactMatch'} group_key=nonan-5-one||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory', 'pubchem']; cas_sources={'502-56-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-cbf7715a673728aa: {'502-56-7': '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": [
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  "ec_numbers": [
    "207-946-5"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Air",
    "strata": "Ground level",
    "population_density": "Rural (<1000 people/square mile)"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [],
  "source": "EF 3.1",
  "identifier": "f7e5501d-486a-4fd3-8af3-52deb837f23e",
  "input_datasets": [
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      "source_flow_uuid": "f7e5501d-486a-4fd3-8af3-52deb837f23e",
      "source_flow_name": "nonan-5-one",
      "source_metadata": {
        "input_file": "/home/cmutel/.local/share/consensus-flow-list/ef-31-flows.json",
        "input_dataset": "EF 3.1",
        "original_context": [
          "Emissions",
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          "Emissions to air, unspecified (long-term)"
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        "9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid",
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}