(2E)-N-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)-3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-2-propenamide

SpectraBase Compound ID	CYX9MCA4Mfi
InChI	InChI=1S/C29H28BrN3O3/c1-20-29(21(2)33(32-20)18-23-7-5-4-6-8-23)31-28(34)16-10-22-9-15-27(35-3)24(17-22)19-36-26-13-11-25(30)12-14-26/h4-17H,18-19H2,1-3H3,(H,31,34)/b16-10+
InChIKey	SQQPQDDVLCCPJY-MHWRWJLKSA-N Google Search
Mol Weight	546.47 g/mol
Molecular Formula	C29H28BrN3O3
Exact Mass	545.131405 g/mol

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SpectraBase Spectrum ID	GZ16AY6CKbX
Name	(2E)-N-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)-3-{3-[(4-bromophenoxy)methyl]-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/C29H28BrN3O3/c1-20-29(21(2)33(32-20)18-23-7-5-4-6-8-23)31-28(34)16-10-22-9-15-27(35-3)24(17-22)19-36-26-13-11-25(30)12-14-26/h4-17H,18-19H2,1-3H3,(H,31,34)/b16-10+
InChIKey	SQQPQDDVLCCPJY-MHWRWJLKSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_3013
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: 9313547; UBI_ID: UBI-003014
Synonyms	N-(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)-3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-2-propenamide
Temperature	308 °C