For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(2E)-2-cyano-3-{1-[2-(2-isopropyl-5-methylphenoxy)ethyl]-1H-indol-3-yl}-N-(4-methoxyphenyl)-2-propenamide
SpectraBase Compound ID GkWUOvskfwC
InChI InChI=1S/C31H31N3O3/c1-21(2)27-14-9-22(3)17-30(27)37-16-15-34-20-24(28-7-5-6-8-29(28)34)18-23(19-32)31(35)33-25-10-12-26(36-4)13-11-25/h5-14,17-18,20-21H,15-16H2,1-4H3,(H,33,35)/b23-18+
InChIKey JWXTYJFUEKDMAO-PTGBLXJZSA-N
Mol Weight 493.61 g/mol
Molecular Formula C31H31N3O3
Exact Mass 493.236542 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID AGSwyNVlb3L
Name (2E)-2-cyano-3-{1-[2-(2-isopropyl-5-methylphenoxy)ethyl]-1H-indol-3-yl}-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/C31H31N3O3/c1-21(2)27-14-9-22(3)17-30(27)37-16-15-34-20-24(28-7-5-6-8-29(28)34)18-23(19-32)31(35)33-25-10-12-26(36-4)13-11-25/h5-14,17-18,20-21H,15-16H2,1-4H3,(H,33,35)/b23-18+
InChIKey JWXTYJFUEKDMAO-PTGBLXJZSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2754
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: 9313254; UBI_ID: UBI-002755
Synonyms 2-cyano-3-{1-[2-(2-isopropyl-5-methylphenoxy)ethyl]-1H-indol-3-yl}-N-(4-methoxyphenyl)-2-propenamide
Temperature 318 °C