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2-Butanoyl-3-[2-(2-methyl-5-phenylmethoxy-1H-indol-3-yl)ethylamino]cyclohex-2-en-1-one
SpectraBase Compound ID F3REQk2GL9r
InChI InChI=1S/C28H32N2O3/c1-3-8-26(31)28-25(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 CBDDSGHZWNPZHQ-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 Cik2ItJMstN
Name 2-Butanoyl-3-[2-(2-methyl-5-phenylmethoxy-1H-indol-3-yl)ethylamino]cyclohex-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H32N2O3
InChI InChI=1S/C28H32N2O3/c1-3-8-26(31)28-25(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 CBDDSGHZWNPZHQ-UHFFFAOYSA-N
Molecular Weight 444.575 g/mol
SMILES N(C1=C(C(=O)CCC1)C(=O)CCC)CCc1c([nH]c2c1cc(cc2)OCc1ccccc1)C
SPLASH splash10-0f6x-9730000000-b02c78a5cf8c1cbf9fdd
Synonyms 3-[2-(2-methyl-5-phenylmethoxy-1H-indol-3-yl)ethylamino]-2-(1-oxobutyl)-1-cyclohex-2-enone 3-[2-(5-benzoxy-2-methyl-1H-indol-3-yl)ethylamino]-2-butyryl-cyclohex-2-en-1-one 3-[2-(5-benzyloxy-2-methyl-1H-indol-3-yl)ethylamino]-2-butanoyl-cyclohex-2-en-1-one
Wiley ID 1445215