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3-(homoveratrylamino)-5,5-dimethyl-2-(2-phenylacetyl)cyclohex-2-en-1-one
SpectraBase Compound ID BNfWnAomDn4
InChI InChI=1S/C26H31NO4/c1-26(2)16-20(27-13-12-19-10-11-23(30-3)24(15-19)31-4)25(22(29)17-26)21(28)14-18-8-6-5-7-9-18/h5-11,15,27H,12-14,16-17H2,1-4H3
InChIKey UZAAYBKYEAGWBT-UHFFFAOYSA-N
Mol Weight 421.54 g/mol
Molecular Formula C26H31NO4
Exact Mass 421.225308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2hCBhJzh1dv
Name 3-(homoveratrylamino)-5,5-dimethyl-2-(2-phenylacetyl)cyclohex-2-en-1-one
Alternate Name(s) 3-[2-(3,4-dimethoxyphenyl)ethylamino]-5,5-dimethyl-2-(1-oxo-2-phenylethyl)-1-cyclohex-2-enone 3-[2-(3,4-dimethoxyphenyl)ethylamino]-5,5-dimethyl-2-(2-phenylacetyl)cyclohex-2-en-1-one 3-[2-(3,4-dimethoxyphenyl)ethylamino]-5,5-dimethyl-2-(2-phenylethanoyl)cyclohex-2-en-1-one
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Formula C26H31NO4
InChI InChI=1S/C26H31NO4/c1-26(2)16-20(27-13-12-19-10-11-23(30-3)24(15-19)31-4)25(22(29)17-26)21(28)14-18-8-6-5-7-9-18/h5-11,15,27H,12-14,16-17H2,1-4H3
InChIKey UZAAYBKYEAGWBT-UHFFFAOYSA-N
Molecular Weight 421.537 g/mol
SMILES N(C1=C(C(CC(C)(C)C1)=O)C(Cc1ccccc1)=O)CCc1cc(c(OC)cc1)OC
SPLASH splash10-001i-4913100000-59f406394523f7188491
Wiley ID 1443287