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2-[(5-tert-butyl-2-keto-cyclohexyl)methyl]-3,7-dimethyl-oct-6-enal
SpectraBase Compound ID 7T9JcGA3o6V
InChI InChI=1S/C21H36O2/c1-15(2)8-7-9-16(3)18(14-22)12-17-13-19(21(4,5)6)10-11-20(17)23/h8,14,16-19H,7,9-13H2,1-6H3
InChIKey CQYOZEBWOVIMQW-UHFFFAOYSA-N
Mol Weight 320.5 g/mol
Molecular Formula C21H36O2
Exact Mass 320.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID gDza6q7Zfz
Name 2-[(5-tert-butyl-2-keto-cyclohexyl)methyl]-3,7-dimethyl-oct-6-enal
Alternate Name(s) 2-[(5-tert-butyl-2-oxidanylidene-cyclohexyl)methyl]-3,7-dimethyl-oct-6-enal 2-[(5-tert-butyl-2-oxo-cyclohexyl)methyl]-3,7-dimethyl-oct-6-enal 2-[(5-tert-butyl-2-oxocyclohexyl)methyl]-3,7-dimethyl-6-octenal
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Formula C21H36O2
InChI InChI=1S/C21H36O2/c1-15(2)8-7-9-16(3)18(14-22)12-17-13-19(21(4,5)6)10-11-20(17)23/h8,14,16-19H,7,9-13H2,1-6H3
InChIKey CQYOZEBWOVIMQW-UHFFFAOYSA-N
Molecular Weight 320.517 g/mol
SMILES C1(C(CCC(C1)C(C)(C)C)=O)CC(C=O)C(CCC=C(C)C)C
SPLASH splash10-0a4k-9801000000-bfcba78764df739c20cc
Source of Spectrum K-2001-321-13
Wiley ID 1578559