N-[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-4-methyl-3,5-dinitrobenzamide

SpectraBase Compound ID	KfHelMSFSoK
InChI	InChI=1S/C20H18ClN5O5/c1-11-17(25(28)29)8-15(9-18(11)26(30)31)20(27)22-19-12(2)23-24(13(19)3)10-14-6-4-5-7-16(14)21/h4-9H,10H2,1-3H3,(H,22,27)
InChIKey	ZGGNFEWUFPGTFQ-UHFFFAOYSA-N Google Search
Mol Weight	443.85 g/mol
Molecular Formula	C20H18ClN5O5
Exact Mass	443.099646 g/mol

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SpectraBase Spectrum ID	9nfHKpGkzUn
Name	N-[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-4-methyl-3,5-dinitrobenzamide
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/C20H18ClN5O5/c1-11-17(25(28)29)8-15(9-18(11)26(30)31)20(27)22-19-12(2)23-24(13(19)3)10-14-6-4-5-7-16(14)21/h4-9H,10H2,1-3H3,(H,22,27)
InChIKey	ZGGNFEWUFPGTFQ-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_4132
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: UZI/9151548; Labnumber: BAM_UACK/003434; UZI_ID: UZI-004134
Temperature	318 °C