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(2E)-3-{1-[2-(4-chloro-3-methylphenoxy)ethyl]-1H-indol-3-yl}-2-cyano-N-(tetrahydro-2-furanylmethyl)-2-propenamide
SpectraBase Compound ID Emen90TSjSN
InChI InChI=1S/C26H26ClN3O3/c1-18-13-21(8-9-24(18)27)33-12-10-30-17-20(23-6-2-3-7-25(23)30)14-19(15-28)26(31)29-16-22-5-4-11-32-22/h2-3,6-9,13-14,17,22H,4-5,10-12,16H2,1H3,(H,29,31)/b19-14+
InChIKey GKSGMMDURUCARK-XMHGGMMESA-N
Mol Weight 463.97 g/mol
Molecular Formula C26H26ClN3O3
Exact Mass 463.166269 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2n8B4XtjHDw
Name (2E)-3-{1-[2-(4-chloro-3-methylphenoxy)ethyl]-1H-indol-3-yl}-2-cyano-N-(tetrahydro-2-furanylmethyl)-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/C26H26ClN3O3/c1-18-13-21(8-9-24(18)27)33-12-10-30-17-20(23-6-2-3-7-25(23)30)14-19(15-28)26(31)29-16-22-5-4-11-32-22/h2-3,6-9,13-14,17,22H,4-5,10-12,16H2,1H3,(H,29,31)/b19-14+
InChIKey GKSGMMDURUCARK-XMHGGMMESA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_15665
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: C75034; Labnumber: SPDEM-1529; SBI_ID: SBI-015668
Synonyms 3-{1-[2-(4-chloro-3-methylphenoxy)ethyl]-1H-indol-3-yl}-2-cyano-N-(tetrahydro-2-furanylmethyl)-2-propenamide
Temperature 318 °C