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N-(4-chlorobenzyl)-2-(1-p-toluoylindol-3-yl)acetamide

View entire compound with spectra: 1 NMR, and 2 MS (GC)

N-(4-chlorobenzyl)-2-(1-p-toluoylindol-3-yl)acetamide
SpectraBase Compound ID 40IZGryILHB
InChI InChI=1S/C25H21ClN2O2/c1-17-6-10-19(11-7-17)25(30)28-16-20(22-4-2-3-5-23(22)28)14-24(29)27-15-18-8-12-21(26)13-9-18/h2-13,16H,14-15H2,1H3,(H,27,29)
InChIKey UNYNRMUPSMVAHV-UHFFFAOYSA-N
Mol Weight 416.91 g/mol
Molecular Formula C25H21ClN2O2
Exact Mass 416.129156 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DyJFfo2riBy
Name N-(4-Chlorobenzyl)-2-(1-p-toluoylindol-3-yl)acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 416.129155622 u
Formula C25H21ClN2O2
InChI InChI=1S/C25H21ClN2O2/c1-17-6-10-19(11-7-17)25(30)28-16-20(22-4-2-3-5-23(22)28)14-24(29)27-15-18-8-12-21(26)13-9-18/h2-13,16H,14-15H2,1H3,(H,27,29)
InChIKey UNYNRMUPSMVAHV-UHFFFAOYSA-N
Molecular Weight 416.908 g/mol
SMILES C1=CC=C2C(=CN(C(C3=CC=C(C=C3)C)=O)C2=C1)CC(NCC1=CC=C(C=C1)Cl)=O