benzoic acid, 4-[[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino]-,methyl ester

SpectraBase Compound ID	4nxvIsHf65o
InChI	InChI=1S/C13H12BrN3O3/c1-17-11(10(14)7-15-17)12(18)16-9-5-3-8(4-6-9)13(19)20-2/h3-7H,1-2H3,(H,16,18)
InChIKey	NEHZGAPLAZOTFP-UHFFFAOYSA-N Google Search
Mol Weight	338.16 g/mol
Molecular Formula	C13H12BrN3O3
Exact Mass	337.006204 g/mol

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SpectraBase Spectrum ID	AdkuWS16dVC
Name	methyl 4-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}benzoate
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C13H12BrN3O3/c1-17-11(10(14)7-15-17)12(18)16-9-5-3-8(4-6-9)13(19)20-2/h3-7H,1-2H3,(H,16,18)
InChIKey	NEHZGAPLAZOTFP-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_4587
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: 8028322; UBI_ID: UBI-004588
Temperature	318 °C