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Butanoic acid, 4-(2-methylcyclohexanon-3-yl), (1-phenyl-2-dimethylamino)propyl ester
SpectraBase Compound ID BbeATbc8qp8
InChI InChI=1S/C22H33NO3/c1-16-18(12-8-14-20(16)24)13-9-15-21(25)26-22(17(2)23(3)4)19-10-6-5-7-11-19/h5-7,10-11,16-18,22H,8-9,12-15H2,1-4H3
InChIKey SJZVFPNYOZPTCL-UHFFFAOYSA-N
Mol Weight 359.5 g/mol
Molecular Formula C22H33NO3
Exact Mass 359.246044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3W7y6rF4Jo
Name Butanoic acid, 4-(2-methylcyclohexanon-3-yl), (1-phenyl-2-dimethylamino)propyl ester
Alternate Name(s) 4-(2-Methyl-3-oxocyclohexyl)butanoic acid [2-(dimethylamino)-1-phenylpropyl] ester [2-(dimethylamino)-1-phenylpropyl] 4-(2-methyl-3-oxocyclohexyl)butanoate [2-(dimethylamino)-1-phenyl-propyl] 4-(2-methyl-3-oxo-cyclohexyl)butanoate [2-(dimethylamino)-1-phenyl-propyl] 4-(2-methyl-3-oxidanylidene-cyclohexyl)butanoate
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Formula C22H33NO3
InChI InChI=1S/C22H33NO3/c1-16-18(12-8-14-20(16)24)13-9-15-21(25)26-22(17(2)23(3)4)19-10-6-5-7-11-19/h5-7,10-11,16-18,22H,8-9,12-15H2,1-4H3
InChIKey SJZVFPNYOZPTCL-UHFFFAOYSA-N
Molecular Weight 359.510 g/mol
SMILES C1(CCCC(=O)C1C)CCCC(=O)OC(C(C)N(C)C)c1ccccc1
SPLASH splash10-00di-9100000000-f9b50c235e01e50fda76
Wiley ID 1479036