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2-Butanoyl-3-[2-(3,4-diethoxyphenyl)ethylamino]-5-phenyl-cyclohex-2-en-1-one
SpectraBase Compound ID G0I5bNZPgst
InChI InChI=1S/C28H35NO4/c1-4-10-24(30)28-23(18-22(19-25(28)31)21-11-8-7-9-12-21)29-16-15-20-13-14-26(32-5-2)27(17-20)33-6-3/h7-9,11-14,17,22,29H,4-6,10,15-16,18-19H2,1-3H3
InChIKey RBAJGAYYGOVLAB-UHFFFAOYSA-N
Mol Weight 449.6 g/mol
Molecular Formula C28H35NO4
Exact Mass 449.256609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D7aD0sv1joc
Name 2-Butanoyl-3-[2-(3,4-diethoxyphenyl)ethylamino]-5-phenyl-cyclohex-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H35NO4
InChI InChI=1S/C28H35NO4/c1-4-10-24(30)28-23(18-22(19-25(28)31)21-11-8-7-9-12-21)29-16-15-20-13-14-26(32-5-2)27(17-20)33-6-3/h7-9,11-14,17,22,29H,4-6,10,15-16,18-19H2,1-3H3
InChIKey RBAJGAYYGOVLAB-UHFFFAOYSA-N
Molecular Weight 449.591 g/mol
SMILES N(C1=C(C(CC(c2ccccc2)C1)=O)C(=O)CCC)CCc1cc(OCC)c(cc1)OCC
SPLASH splash10-006x-4960100000-ca1dfa20e8be36fb799d
Synonyms 2-Butyryl-3-[2-(3,4-diethoxyphenyl)ethylamino]-5-phenyl-cyclohex-2-en-1-one 3-[2-(3,4-diethoxyphenyl)ethylamino]-2-(1-oxobutyl)-5-phenyl-1-cyclohex-2-enone
Wiley ID 1445222