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1,5-Di(1H-indol-3-yl)-1,5-diphenylpentan-3-one

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1,5-Di(1H-indol-3-yl)-1,5-diphenylpentan-3-one
SpectraBase Compound ID EdPA46b0H0N
InChI InChI=1S/C33H28N2O/c36-25(19-28(23-11-3-1-4-12-23)30-21-34-32-17-9-7-15-26(30)32)20-29(24-13-5-2-6-14-24)31-22-35-33-18-10-8-16-27(31)33/h1-18,21-22,28-29,34-35H,19-20H2
InChIKey UWYZZFZVBNNJKB-UHFFFAOYSA-N
Mol Weight 468.6 g/mol
Molecular Formula C33H28N2O
Exact Mass 468.220164 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 68BpwNWCyZK
Name 1,5-di(1H-Indol-3-yl)-1,5-diphenylpentan-3-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 468.220163529 u
Formula C33H28N2O
InChI InChI=1S/C33H28N2O/c36-25(19-28(23-11-3-1-4-12-23)30-21-34-32-17-9-7-15-26(30)32)20-29(24-13-5-2-6-14-24)31-22-35-33-18-10-8-16-27(31)33/h1-18,21-22,28-29,34-35H,19-20H2
InChIKey UWYZZFZVBNNJKB-UHFFFAOYSA-N
Molecular Weight 468.600 g/mol
SMILES C(CC(C=1C2=C(NC1)C=CC=C2)C1=CC=CC=C1)(CC(C1=CC=CC=C1)C1=CNC2=C1C=CC=C2)=O