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2-Cyclohexen-1-one, 2-[2-(3,4-diethoxyphenyl)acetyl]-5,5-dimethyl-3-[(phenylmethyl)amino]-
SpectraBase Compound ID BxKIxlggVpO
InChI InChI=1S/C27H33NO4/c1-5-31-24-13-12-20(15-25(24)32-6-2)14-22(29)26-21(16-27(3,4)17-23(26)30)28-18-19-10-8-7-9-11-19/h7-13,15,28H,5-6,14,16-18H2,1-4H3
InChIKey QMBPVCIELMAIIZ-UHFFFAOYSA-N
Mol Weight 435.6 g/mol
Molecular Formula C27H33NO4
Exact Mass 435.240959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HoO4YAqs0P3
Name 2-Cyclohexen-1-one, 2-[2-(3,4-diethoxyphenyl)acetyl]-5,5-dimethyl-3-[(phenylmethyl)amino]-
Alternate Name(s) 2-[2-(3,4-diethoxyphenyl)-1-oxoethyl]-5,5-dimethyl-3-[(phenylmethyl)amino]-1-cyclohex-2-enone 3-(benzylamino)-2-[2-(3,4-diethoxyphenyl)acetyl]-5,5-dimethylcyclohex-2-en-1-one 2-[2-(3,4-diethoxyphenyl)ethanoyl]-5,5-dimethyl-3-[(phenylmethyl)amino]cyclohex-2-en-1-one
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Formula C27H33NO4
InChI InChI=1S/C27H33NO4/c1-5-31-24-13-12-20(15-25(24)32-6-2)14-22(29)26-21(16-27(3,4)17-23(26)30)28-18-19-10-8-7-9-11-19/h7-13,15,28H,5-6,14,16-18H2,1-4H3
InChIKey QMBPVCIELMAIIZ-UHFFFAOYSA-N
Molecular Weight 435.564 g/mol
SMILES N(C1=C(C(CC(C)(C)C1)=O)C(Cc1cc(OCC)c(cc1)OCC)=O)Cc1ccccc1
SPLASH splash10-052f-9250100000-d0b909c3ae87435af03a
Source of Spectrum IY-1-4596-2
Wiley ID 1653945