benzoic acid, 2-[[3-[(4-bromophenyl)sulfonyl]-1-oxopropyl]amino]-, methyl ester

SpectraBase Compound ID	F1bN0XLFSMd
InChI	InChI=1S/C17H16BrNO5S/c1-24-17(21)14-4-2-3-5-15(14)19-16(20)10-11-25(22,23)13-8-6-12(18)7-9-13/h2-9H,10-11H2,1H3,(H,19,20)
InChIKey	NUBQOILMKZCPGN-UHFFFAOYSA-N Google Search
Mol Weight	426.28 g/mol
Molecular Formula	C17H16BrNO5S
Exact Mass	424.993257 g/mol

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SpectraBase Spectrum ID	EkmHYiKyRnD
Name	benzoic acid, 2-[[3-[(4-bromophenyl)sulfonyl]-1-oxopropyl]amino]-, methyl ester
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/C17H16BrNO5S/c1-24-17(21)14-4-2-3-5-15(14)19-16(20)10-11-25(22,23)13-8-6-12(18)7-9-13/h2-9H,10-11H2,1H3,(H,19,20)
InChIKey	NUBQOILMKZCPGN-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB3_9000_7595
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: NMR/12238311