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(2E)-3-{1-[2-(4-chloro-3-methylphenoxy)ethyl]-1H-indol-3-yl}-2-cyano-N-cyclopentyl-2-propenamide
SpectraBase Compound ID 6QXwjD8rWGH
InChI InChI=1S/C26H26ClN3O2/c1-18-14-22(10-11-24(18)27)32-13-12-30-17-20(23-8-4-5-9-25(23)30)15-19(16-28)26(31)29-21-6-2-3-7-21/h4-5,8-11,14-15,17,21H,2-3,6-7,12-13H2,1H3,(H,29,31)/b19-15+
InChIKey FKMYKODCYLWERX-XDJHFCHBSA-N
Mol Weight 447.97 g/mol
Molecular Formula C26H26ClN3O2
Exact Mass 447.171355 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AJxnnnO3n0u
Name (2E)-3-{1-[2-(4-chloro-3-methylphenoxy)ethyl]-1H-indol-3-yl}-2-cyano-N-cyclopentyl-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/C26H26ClN3O2/c1-18-14-22(10-11-24(18)27)32-13-12-30-17-20(23-8-4-5-9-25(23)30)15-19(16-28)26(31)29-21-6-2-3-7-21/h4-5,8-11,14-15,17,21H,2-3,6-7,12-13H2,1H3,(H,29,31)/b19-15+
InChIKey FKMYKODCYLWERX-XDJHFCHBSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2767
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: 9312493; UBI_ID: UBI-002768
Synonyms 3-{1-[2-(4-chloro-3-methylphenoxy)ethyl]-1H-indol-3-yl}-2-cyano-N-cyclopentyl-2-propenamide
Temperature 318 °C