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3-[2-(3,4-diethoxyphenyl)ethylamino]-2-(1-oxopropyl)-5-phenyl-1-cyclohex-2-enone
SpectraBase Compound ID J3KdrrW9YB6
InChI InChI=1S/C27H33NO4/c1-4-23(29)27-22(17-21(18-24(27)30)20-10-8-7-9-11-20)28-15-14-19-12-13-25(31-5-2)26(16-19)32-6-3/h7-13,16,21,28H,4-6,14-15,17-18H2,1-3H3
InChIKey QAJYVGWVBSOFQS-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 6I6vlIf2GRZ
Name 3-[2-(3,4-diethoxyphenyl)ethylamino]-2-(1-oxopropyl)-5-phenyl-1-cyclohex-2-enone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H33NO4
InChI InChI=1S/C27H33NO4/c1-4-23(29)27-22(17-21(18-24(27)30)20-10-8-7-9-11-20)28-15-14-19-12-13-25(31-5-2)26(16-19)32-6-3/h7-13,16,21,28H,4-6,14-15,17-18H2,1-3H3
InChIKey QAJYVGWVBSOFQS-UHFFFAOYSA-N
Molecular Weight 435.564 g/mol
SMILES N(C1=C(C(CC(c2ccccc2)C1)=O)C(=O)CC)CCc1cc(OCC)c(cc1)OCC
SPLASH splash10-0a4l-4970200000-7cf83faa52c15cc78d98
Synonyms 3-[2-(3,4-diethoxyphenyl)ethylamino]-5-phenyl-2-propanoyl-cyclohex-2-en-1-one 3-[2-(3,4-diethoxyphenyl)ethylamino]-5-phenyl-2-propionyl-cyclohex-2-en-1-one
Wiley ID 1445164