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2-(Benzoyloxy)-3-(N-benzylamino)-5,5-dimethylcyclohex-2-en-1-one
SpectraBase Compound ID D7rfIHbkwOK
InChI InChI=1S/C22H23NO3/c1-22(2)13-18(23-15-16-9-5-3-6-10-16)20(19(24)14-22)26-21(25)17-11-7-4-8-12-17/h3-12,23H,13-15H2,1-2H3
InChIKey MKWDYQNMJDLEMY-UHFFFAOYSA-N
Mol Weight 349.43 g/mol
Molecular Formula C22H23NO3
Exact Mass 349.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4iqDywLc8mz
Name 2-(Benzoyloxy)-3-(N-benzylamino)-5,5-dimethylcyclohex-2-en-1-one
Alternate Name(s) 2-(benzylamino)-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl benzoate benzoic acid[2-(benzylamino)-6-keto-4,4-dimethyl-cyclohexen-1-yl]ester benzoic acid[4,4-dimethyl-6-oxo-2-[(phenylmethyl)amino]-1-cyclohexenyl]ester [2-(benzylamino)-4,4-dimethyl-6-oxo-cyclohexen-1-yl]benzoate [4,4-dimethyl-6-oxidanylidene-2-[(phenylmethyl)amino]cyclohexen-1-yl]benzoate benzoic acid [4,4-dimethyl-6-oxo-2-[(phenylmethyl)amino]-1-cyclohexenyl] ester [2-(benzylamino)-4,4-dimethyl-6-oxocyclohexen-1-yl] benzoate [2-(benzylamino)-4,4-dimethyl-6-oxo-cyclohexen-1-yl] benzoate [4,4-dimethyl-6-oxidanylidene-2-[(phenylmethyl)amino]cyclohexen-1-yl] benzoate
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Formula C22H23NO3
InChI InChI=1S/C22H23NO3/c1-22(2)13-18(23-15-16-9-5-3-6-10-16)20(19(24)14-22)26-21(25)17-11-7-4-8-12-17/h3-12,23H,13-15H2,1-2H3
InChIKey MKWDYQNMJDLEMY-UHFFFAOYSA-N
Molecular Weight 349.430 g/mol
SMILES N(C1=C(C(CC(C1)(C)C)=O)OC(c1ccccc1)=O)Cc1ccccc1
SPLASH splash10-052f-9852000000-cb70065b59e071651290
Source of Spectrum K1-2003-198-8
Wiley ID 1520631