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(2E)-3-{1-[2-(4-chloro-3-methylphenoxy)ethyl]-1H-indol-3-yl}-2-cyano-N-(4-methoxyphenyl)-2-propenamide
SpectraBase Compound ID 8dwkLhlaD0i
InChI InChI=1S/C28H24ClN3O3/c1-19-15-24(11-12-26(19)29)35-14-13-32-18-21(25-5-3-4-6-27(25)32)16-20(17-30)28(33)31-22-7-9-23(34-2)10-8-22/h3-12,15-16,18H,13-14H2,1-2H3,(H,31,33)/b20-16+
InChIKey YKCOYGNLRPPMBL-CAPFRKAQSA-N
Mol Weight 485.97 g/mol
Molecular Formula C28H24ClN3O3
Exact Mass 485.150619 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Io9fXpB56n4
Name (2E)-3-{1-[2-(4-chloro-3-methylphenoxy)ethyl]-1H-indol-3-yl}-2-cyano-N-(4-methoxyphenyl)-2-propenamide
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/C28H24ClN3O3/c1-19-15-24(11-12-26(19)29)35-14-13-32-18-21(25-5-3-4-6-27(25)32)16-20(17-30)28(33)31-22-7-9-23(34-2)10-8-22/h3-12,15-16,18H,13-14H2,1-2H3,(H,31,33)/b20-16+
InChIKey YKCOYGNLRPPMBL-CAPFRKAQSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2770
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: 9312880; UBI_ID: UBI-002771
Synonyms 3-{1-[2-(4-chloro-3-methylphenoxy)ethyl]-1H-indol-3-yl}-2-cyano-N-(4-methoxyphenyl)-2-propenamide
Temperature 318 °C