<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">62243</id>
  <title nil="true"/>
  <common-name>1,2,3,4,5,6,7,8,9,10-Decahydro-5,9-methanobenzocycloocten-11-one</common-name>
  <description>1,2,3,4,5,6,7,8,9,10-Decahydro-5,9-methanobenzocycloocten-11-one is an organic oxygen compound with the chemical formula C14H20O1 and an average molecular weight of 204.31 g/mol. 1,2,3,4,5,6,7,8,9,10-Decahydro-5,9-methanobenzocycloocten-11-one belongs to the carbonyl compounds, a subclass of organooxygen compounds within the organic compounds. Industrially, this substance is utilized as a fragrance.</description>
  <cas>22690-27-3</cas>
  <pubchem-id>90830</pubchem-id>
  <chemical-formula>C14H20O1</chemical-formula>
  <weight>204.31</weight>
  <appearance nil="true"/>
  <melting-point nil="true"/>
  <boiling-point nil="true"/>
  <density nil="true"/>
  <solubility nil="true"/>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure nil="true"/>
  <target nil="true"/>
  <mechanism-of-toxicity nil="true"/>
  <metabolism nil="true"/>
  <toxicity nil="true"/>
  <lethaldose nil="true"/>
  <carcinogenicity nil="true"/>
  <use-source nil="true"/>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2026-03-31T21:43:52Z</created-at>
  <updated-at type="dateTime">2026-08-19T06:59:03Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id nil="true"/>
  <omim-id nil="true"/>
  <chebi-id nil="true"/>
  <biocyc-id nil="true"/>
  <ctd-id nil="true"/>
  <stitch-id nil="true"/>
  <drugbank-id nil="true"/>
  <pdb-id nil="true"/>
  <actor-id nil="true"/>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>CC1C2CCCC(C2=O)C2=C1CCCC2</moldb-smiles>
  <moldb-formula>C14H20O1</moldb-formula>
  <moldb-inchi>InChI=1S/C14H20O/c1-9-10-5-2-3-6-12(10)13-8-4-7-11(9)14(13)15/h9,11,13H,2-8H2,1H3</moldb-inchi>
  <moldb-inchikey>WJPULIHSNITDMU-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">204.313</moldb-average-mass>
  <moldb-mono-mass type="decimal">204.151415</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.7</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>82013</chemspider-id>
  <structure-image-file-name nil="true"/>
  <structure-image-content-type nil="true"/>
  <structure-image-file-size type="integer" nil="true"/>
  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM058136</chemdb-id>
  <dsstox-id>DTXSID4051877</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00012182</susdat-id>
  <iupac>8-methyltricyclo[7.3.1.02,7]tridec-2(7)-en-13-one</iupac>
  <moldb-polar-surface-area nil="true"/>
  <moldb-refractivity nil="true"/>
  <moldb-polarizability nil="true"/>
  <moldb-rotatable-bond-count nil="true"/>
  <moldb-acceptor-count nil="true"/>
  <moldb-donor-count nil="true"/>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic nil="true"/>
  <moldb-physiological-charge nil="true"/>
  <moldb-number-of-rings nil="true"/>
  <moldb-alogps-logp nil="true"/>
  <moldb-alogps-logs nil="true"/>
  <moldb-alogps-solubility nil="true"/>
  <kingdom>Organic compounds</kingdom>
  <superklass>Organic oxygen compounds</superklass>
  <klass>Organooxygen compounds</klass>
  <subklass>Carbonyl compounds</subklass>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0088191</sync-id>
  <structure-inchikey>WJPULIHSNITDMU-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>220000000000000000000008000000002080100000000000000000000000000000000000800100000000022000000000000004000000000000000000000000000000000000000000000000008020000000000000000000000100800000041000000000000000000000000000020000000000000000000000000000000040004000000000000080000000000000001000000000000000000000000000000000000000000000000022000000000000000000000204000000000000000000000000000000000000000000000000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAPAAAAEQAAAIABBgBgAAAAAQMGAGAAAAAD
AQYAYAAAAAMBBgBgAAAAAgIGAGAAAAACAgYAYAAAAAICBgBgAAAAAwEGACgA
AAADBAgAKAAAAAMCBgAoAAAAAwQGACgAAAADBAYAYAAAAAICBgBgAAAAAgIG
AGAAAAACAgYAYAAAAAICCwABAAECAAIDAAMEAAQFAAUGAAYHAAcICAIGCQAJ
CggCCgsACwwADA0ADQ4ACgEABwIADgkAQgMAAAAGAQoJBgcCBgMEBQYHAgYL
DA0OCQoXBAAAAAAAAAAW
</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:15:20Z</structure-indexed-at>
</compound>
