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4-(2-nitrophenyl)-3-((2-phenyl-1H-indol-3-yl)methyl)-but-3-en-2-one
SpectraBase Compound ID CvoAbgsKgMY
InChI InChI=1S/C25H20N2O3/c1-17(28)20(15-19-11-5-8-14-24(19)27(29)30)16-22-21-12-6-7-13-23(21)26-25(22)18-9-3-2-4-10-18/h2-15,26H,16H2,1H3/b20-15+
InChIKey BNEZHRUNDAJOPJ-HMMYKYKNSA-N
Mol Weight 396.45 g/mol
Molecular Formula C25H20N2O3
Exact Mass 396.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2GWHo4DjEG
Name 4-(2-nitrophenyl)-3-((2-phenyl-1H-indol-3-yl)methyl)-but-3-en-2-one
Alternate Name(s) (E)-4-(2-nitrophenyl)-3-((2-phenyl-1H-indol-3-yl)methyl)but-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H20N2O3
InChI InChI=1S/C25H20N2O3/c1-17(28)20(15-19-11-5-8-14-24(19)27(29)30)16-22-21-12-6-7-13-23(21)26-25(22)18-9-3-2-4-10-18/h2-15,26H,16H2,1H3/b20-15+
InChIKey BNEZHRUNDAJOPJ-HMMYKYKNSA-N
Molecular Weight 396.446 g/mol
SMILES [nH]1c2ccccc2c(c1-c1ccccc1)C\C(=C/c1c(cccc1)[N+](=O)[O-])C(=O)C
SPLASH splash10-0udl-0569000000-80f047d2a4d992a89d7d
Source of Spectrum J-77-8459-3e
Wiley ID 1747006