For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(E)-1,5-bis(2-chlorophenyl)-5-(1H-indol-3-yl)pent-1-en-3-one

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

(E)-1,5-bis(2-chlorophenyl)-5-(1H-indol-3-yl)pent-1-en-3-one
SpectraBase Compound ID BFyE8NwLeBA
InChI InChI=1S/C25H19Cl2NO/c26-23-10-4-1-7-17(23)13-14-18(29)15-21(19-8-2-5-11-24(19)27)22-16-28-25-12-6-3-9-20(22)25/h1-14,16,21,28H,15H2/b14-13+
InChIKey VQWKZCANNFTTET-BUHFOSPRSA-N
Mol Weight 420.34 g/mol
Molecular Formula C25H19Cl2NO
Exact Mass 419.08437 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7apL3Fr4q6C
Name (E)-1,5-bis(2-Chlorophenyl)-5-(1H-indol-3-yl)pent-1-en-3-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 419.084369635 u
Formula C25H19Cl2NO
InChI InChI=1S/C25H19Cl2NO/c26-23-10-4-1-7-17(23)13-14-18(29)15-21(19-8-2-5-11-24(19)27)22-16-28-25-12-6-3-9-20(22)25/h1-14,16,21,28H,15H2/b14-13+
InChIKey VQWKZCANNFTTET-BUHFOSPRSA-N
Molecular Weight 420.339 g/mol
SMILES C(=O)(CC(C1=C(C=CC=C1)Cl)C=1C2=C(C=CC=C2)NC1)\C=C\C1=C(C=CC=C1)Cl