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(2Z)-3-[1-(2-chlorobenzyl)-2-methyl-1H-indol-3-yl]-N-(5-chloro-2-methylphenyl)-2-cyano-2-propenamide
SpectraBase Compound ID CgXp0RnKVKb
InChI InChI=1S/C27H21Cl2N3O/c1-17-11-12-21(28)14-25(17)31-27(33)20(15-30)13-23-18(2)32(26-10-6-4-8-22(23)26)16-19-7-3-5-9-24(19)29/h3-14H,16H2,1-2H3,(H,31,33)/b20-13-
InChIKey KUSCFYFTBHXZEZ-MOSHPQCFSA-N
Mol Weight 474.39 g/mol
Molecular Formula C27H21Cl2N3O
Exact Mass 473.106168 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DNhXpmx6gwj
Name (2Z)-3-[1-(2-chlorobenzyl)-2-methyl-1H-indol-3-yl]-N-(5-chloro-2-methylphenyl)-2-cyano-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/C27H21Cl2N3O/c1-17-11-12-21(28)14-25(17)31-27(33)20(15-30)13-23-18(2)32(26-10-6-4-8-22(23)26)16-19-7-3-5-9-24(19)29/h3-14H,16H2,1-2H3,(H,31,33)/b20-13-
InChIKey KUSCFYFTBHXZEZ-MOSHPQCFSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_10120
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: 1002523; UBI_ID: UBI-010123
Synonyms 3-[1-(2-chlorobenzyl)-2-methyl-1H-indol-3-yl]-N-(5-chloro-2-methylphenyl)-2-cyano-2-propenamide
Temperature 315 °C