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3-Butyl-5,5-dimethylcyclohex-2-enone
SpectraBase Compound ID IxNjbpgOTVn
InChI InChI=1S/C12H20O/c1-4-5-6-10-7-11(13)9-12(2,3)8-10/h7H,4-6,8-9H2,1-3H3
InChIKey ORPKYSDROGAQAE-UHFFFAOYSA-N
Mol Weight 180.29 g/mol
Molecular Formula C12H20O
Exact Mass 180.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bpi92Ccg2Q0
Name 3-Butyl-5,5-dimethylcyclohex-2-enone
Alternate Name(s) 3-Butyl-5,5-dimethyl-2-cyclohexen-1-one 3-Butyl-5,5-dimethyl-1-cyclohex-2-enone 3-Butyl-5,5-dimethylcyclohex-2-en-1-one
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Formula C12H20O
InChI InChI=1S/C12H20O/c1-4-5-6-10-7-11(13)9-12(2,3)8-10/h7H,4-6,8-9H2,1-3H3
InChIKey ORPKYSDROGAQAE-UHFFFAOYSA-N
Molecular Weight 180.291 g/mol
SMILES C1(C=C(CC(C1)(C)C)CCCC)=O
SPLASH splash10-001i-9100000000-27edca2fe7a14c48807b
Source of Spectrum KC-61-2323-13
Wiley ID 1628037