(2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-cyano-N-cyclohexyl-2-propenamide

SpectraBase Compound ID	2q9EgIHbwPc
InChI	InChI=1S/C25H24ClN3O/c26-23-12-6-4-8-18(23)16-29-17-20(22-11-5-7-13-24(22)29)14-19(15-27)25(30)28-21-9-2-1-3-10-21/h4-8,11-14,17,21H,1-3,9-10,16H2,(H,28,30)/b19-14+
InChIKey	QHHCVTDXDXZLJJ-XMHGGMMESA-N Google Search
Mol Weight	417.94 g/mol
Molecular Formula	C25H24ClN3O
Exact Mass	417.16079 g/mol

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SpectraBase Spectrum ID	38bb4Yv9wyf
Name	(2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-cyano-N-cyclohexyl-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/C25H24ClN3O/c26-23-12-6-4-8-18(23)16-29-17-20(22-11-5-7-13-24(22)29)14-19(15-27)25(30)28-21-9-2-1-3-10-21/h4-8,11-14,17,21H,1-3,9-10,16H2,(H,28,30)/b19-14+
InChIKey	QHHCVTDXDXZLJJ-XMHGGMMESA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_11970
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: 1003033; UBI_ID: UBI-011973
Synonyms	3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-cyano-N-cyclohexyl-2-propenamide
Temperature	318 °C