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2-[1-[2-(2-methyl-5-phenylmethoxy-1H-indol-3-yl)ethylamino]butylidene]cyclohexane-1,3-dione
SpectraBase Compound ID Cn50CWTUHX4
InChI InChI=1S/C28H32N2O3/c1-3-8-25(28-26(31)11-7-12-27(28)32)29-16-15-22-19(2)30-24-14-13-21(17-23(22)24)33-18-20-9-5-4-6-10-20/h4-6,9-10,13-14,17,29-30H,3,7-8,11-12,15-16,18H2,1-2H3
InChIKey AGHXEBKCNYAXGW-UHFFFAOYSA-N
Mol Weight 444.6 g/mol
Molecular Formula C28H32N2O3
Exact Mass 444.241293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 70sXMLRnGf3
Name 2-[1-[2-(2-methyl-5-phenylmethoxy-1H-indol-3-yl)ethylamino]butylidene]cyclohexane-1,3-dione
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Formula C28H32N2O3
InChI InChI=1S/C28H32N2O3/c1-3-8-25(28-26(31)11-7-12-27(28)32)29-16-15-22-19(2)30-24-14-13-21(17-23(22)24)33-18-20-9-5-4-6-10-20/h4-6,9-10,13-14,17,29-30H,3,7-8,11-12,15-16,18H2,1-2H3
InChIKey AGHXEBKCNYAXGW-UHFFFAOYSA-N
Molecular Weight 444.575 g/mol
SMILES N(C(=C1C(=O)CCCC1=O)CCC)CCc1c([nH]c2c1cc(cc2)OCc1ccccc1)C
SPLASH splash10-0w2c-6980000000-cef24d903711a3e7db7b
Synonyms 2-[1-[2-(5-benzoxy-2-methyl-1H-indol-3-yl)ethylamino]butylidene]cyclohexane-1,3-quinone 2-[1-[2-(5-benzyloxy-2-methyl-1H-indol-3-yl)ethylamino]butylidene]cyclohexane-1,3-dione
Wiley ID 1445137