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more general categories information about this item 05. Industrial Uses 05. Industrial Uses solvent [CHEBI:46787] (49) isophorone [CHEBI:34800] (1) 08. Chemical Category 08. Chemical Category main group molecular entity [CHEBI:33579] (25650) p-block molecular entity [CHEBI:33675] (25343) chalcogen molecular entity [CHEBI:33304] (15225) oxygen molecular entity [CHEBI:25806] (14414) organooxygen compound [CHEBI:36963] (11352) carbonyl compound [CHEBI:36586] (5928) ketone [CHEBI:17087] (1288) cyclic ketone [CHEBI:3992] (644) isophorone [CHEBI:34800] (1) organochalcogen compound [CHEBI:36962] (11874) organooxygen compound [CHEBI:36963] (11352) carbonyl compound [CHEBI:36586] (5928) ketone [CHEBI:17087] (1288) cyclic ketone [CHEBI:3992] (644) isophorone [CHEBI:34800] (1) carbon group molecular entity [CHEBI:33582] (23847) organic molecular entity [CHEBI:50860] (23769) heteroorganic entity [CHEBI:33285] (15197) organochalcogen compound [CHEBI:36962] (11874) organooxygen compound [CHEBI:36963] (11352) carbonyl compound [CHEBI:36586] (5928) ketone [CHEBI:17087] (1288) cyclic ketone [CHEBI:3992] (644) isophorone [CHEBI:34800] (1) organic molecule [CHEBI:72695] (11399) organic oxo compound [CHEBI:36587] (5932) carbonyl compound [CHEBI:36586] (5928) ketone [CHEBI:17087] (1288) cyclic ketone [CHEBI:3992] (644) isophorone [CHEBI:34800] (1) polyatomic entity [CHEBI:36357] (18777) molecule [CHEBI:25367] (11520) organic molecule [CHEBI:72695] (11399) organic oxo compound [CHEBI:36587] (5932) carbonyl compound [CHEBI:36586] (5928) ketone [CHEBI:17087] (1288) cyclic ketone [CHEBI:3992] (644) isophorone [CHEBI:34800] (1) ChEBI Compound Accession Identifier: [CHEBI:34800] ChEBI Compound Description: A cyclic ketone, the structure of which is that of cyclohex-2-en-1-one substituted at positions 3, 5 and 5. ChEBI Compound Identification Number: 34800 ChEBI InChI Value: InChI=1S/C9H14O/c1-7-4-8(10)6-9(2,3)5-7/h4H,5-6H2,1-3H3 ChEBI InChIKey Value: HJOVHMDZYOCNQW-UHFFFAOYSA-N ChEBI Compound Name: isophorone ChEBI SMILES Value: CC1=CC(=O)CC(C)(C)C1 ChEBI Substance ID: 163425665 ChEBI URL: ChEBI:34800 ChemSpider ID: 6296 Ontomatica Chemical Accession Key (OnChAKey): HJOVHMDZYOCNQW_UHFFFAOYSA_N_000_000000 PubChem Compound ID: 6544
