5-bromo-2-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethoxy}benzoic acid

SpectraBase Compound ID	DOzBBWm2jYU
InChI	InChI=1S/C18H16BrNO6/c1-2-25-18(24)11-3-6-13(7-4-11)20-16(21)10-26-15-8-5-12(19)9-14(15)17(22)23/h3-9H,2,10H2,1H3,(H,20,21)(H,22,23)
InChIKey	XSOMSSRIBHUSGM-UHFFFAOYSA-N Google Search
Mol Weight	422.23 g/mol
Molecular Formula	C18H16BrNO6
Exact Mass	421.0161 g/mol

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SpectraBase Spectrum ID	L9ITdjBeCXf
Name	5-bromo-2-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethoxy}benzoic acid
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/C18H16BrNO6/c1-2-25-18(24)11-3-6-13(7-4-11)20-16(21)10-26-15-8-5-12(19)9-14(15)17(22)23/h3-9H,2,10H2,1H3,(H,20,21)(H,22,23)
InChIKey	XSOMSSRIBHUSGM-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_31682
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: 1843206; SBI_ID: SBI-031686
Temperature	308 °C