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(2Z)-3-[1-(4-chlorobenzyl)-2-methyl-1H-indol-3-yl]-2-cyano-N-(3-methoxyphenyl)-2-propenamide
SpectraBase Compound ID QsULuiLvhu
InChI InChI=1S/C27H22ClN3O2/c1-18-25(14-20(16-29)27(32)30-22-6-5-7-23(15-22)33-2)24-8-3-4-9-26(24)31(18)17-19-10-12-21(28)13-11-19/h3-15H,17H2,1-2H3,(H,30,32)/b20-14-
InChIKey AMEXBLWRZMKJDW-ZHZULCJRSA-N
Mol Weight 455.95 g/mol
Molecular Formula C27H22ClN3O2
Exact Mass 455.140055 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LeE5IxyfJOq
Name (2Z)-3-[1-(4-chlorobenzyl)-2-methyl-1H-indol-3-yl]-2-cyano-N-(3-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/C27H22ClN3O2/c1-18-25(14-20(16-29)27(32)30-22-6-5-7-23(15-22)33-2)24-8-3-4-9-26(24)31(18)17-19-10-12-21(28)13-11-19/h3-15H,17H2,1-2H3,(H,30,32)/b20-14-
InChIKey AMEXBLWRZMKJDW-ZHZULCJRSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_10140
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: 1001104; UBI_ID: UBI-010143
Synonyms 3-[1-(4-chlorobenzyl)-2-methyl-1H-indol-3-yl]-2-cyano-N-(3-methoxyphenyl)-2-propenamide
Temperature 315 °C