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3-[2-(2,5-dimethyl-1H-indol-3-yl)ethylamino]-2-(1-oxopentyl)-5-phenyl-1-cyclohex-2-enone
SpectraBase Compound ID 8SlMVVtIGsu
InChI InChI=1S/C29H34N2O2/c1-4-5-11-27(32)29-26(17-22(18-28(29)33)21-9-7-6-8-10-21)30-15-14-23-20(3)31-25-13-12-19(2)16-24(23)25/h6-10,12-13,16,22,30-31H,4-5,11,14-15,17-18H2,1-3H3
InChIKey WIHOITWLAPDKRG-UHFFFAOYSA-N
Mol Weight 442.6 g/mol
Molecular Formula C29H34N2O2
Exact Mass 442.262028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KZdBqeSso1q
Name 3-[2-(2,5-dimethyl-1H-indol-3-yl)ethylamino]-2-(1-oxopentyl)-5-phenyl-1-cyclohex-2-enone
Alternate Name(s) 3-[2-(2,5-dimethyl-1H-indol-3-yl)ethylamino]-2-pentanoyl-5-phenyl-cyclohex-2-en-1-one 3-[2-(2,5-dimethyl-1H-indol-3-yl)ethylamino]-5-phenyl-2-valeryl-cyclohex-2-en-1-one
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Formula C29H34N2O2
InChI InChI=1S/C29H34N2O2/c1-4-5-11-27(32)29-26(17-22(18-28(29)33)21-9-7-6-8-10-21)30-15-14-23-20(3)31-25-13-12-19(2)16-24(23)25/h6-10,12-13,16,22,30-31H,4-5,11,14-15,17-18H2,1-3H3
InChIKey WIHOITWLAPDKRG-UHFFFAOYSA-N
Molecular Weight 442.603 g/mol
SMILES N(C1=C(C(CC(c2ccccc2)C1)=O)C(=O)CCCC)CCc1c([nH]c2c1cc(cc2)C)C
SPLASH splash10-0a4i-2900000000-ebf6acae582f9b50c97a
Wiley ID 1445751