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1H-indole-3-acetamide, N-[3-chloro-4-(2-pyridinylthio)phenyl]-1-methyl-alpha-oxo-2-phenyl-
SpectraBase Compound ID BOEVidxroou
InChI InChI=1S/C28H20ClN3O2S/c1-32-22-12-6-5-11-20(22)25(26(32)18-9-3-2-4-10-18)27(33)28(34)31-19-14-15-23(21(29)17-19)35-24-13-7-8-16-30-24/h2-17H,1H3,(H,31,34)
InChIKey BEHZNLHWIXEXEH-UHFFFAOYSA-N
Mol Weight 498.0 g/mol
Molecular Formula C28H20ClN3O2S
Exact Mass 497.096476 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IK3LmmBCLGl
Name 1H-indole-3-acetamide, N-[3-chloro-4-(2-pyridinylthio)phenyl]-1-methyl-alpha-oxo-2-phenyl-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C28H20ClN3O2S/c1-32-22-12-6-5-11-20(22)25(26(32)18-9-3-2-4-10-18)27(33)28(34)31-19-14-15-23(21(29)17-19)35-24-13-7-8-16-30-24/h2-17H,1H3,(H,31,34)
InChIKey BEHZNLHWIXEXEH-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_4854
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/17241976; Labnumber: 21c5443