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(2E)-3-{1-[2-(4-tert-butylphenoxy)ethyl]-1H-indol-3-yl}-2-cyano-N-cyclopentyl-2-propenamide
SpectraBase Compound ID 4ZU5K8weCU
InChI InChI=1S/C29H33N3O2/c1-29(2,3)23-12-14-25(15-13-23)34-17-16-32-20-22(26-10-6-7-11-27(26)32)18-21(19-30)28(33)31-24-8-4-5-9-24/h6-7,10-15,18,20,24H,4-5,8-9,16-17H2,1-3H3,(H,31,33)/b21-18+
InChIKey UMCDZGMMNWEJOX-DYTRJAOYSA-N
Mol Weight 455.6 g/mol
Molecular Formula C29H33N3O2
Exact Mass 455.257277 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DIQbTp9x0gc
Name (2E)-3-{1-[2-(4-tert-butylphenoxy)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/C29H33N3O2/c1-29(2,3)23-12-14-25(15-13-23)34-17-16-32-20-22(26-10-6-7-11-27(26)32)18-21(19-30)28(33)31-24-8-4-5-9-24/h6-7,10-15,18,20,24H,4-5,8-9,16-17H2,1-3H3,(H,31,33)/b21-18+
InChIKey UMCDZGMMNWEJOX-DYTRJAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2762
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: 9313309; UBI_ID: UBI-002763
Synonyms 3-{1-[2-(4-tert-butylphenoxy)ethyl]-1H-indol-3-yl}-2-cyano-N-cyclopentyl-2-propenamide
Temperature 318 °C