benzoic acid, 4-[[(4-methoxy-6-nitro-2-benzothiazolyl)amino]carbonyl]-, methyl ester

SpectraBase Compound ID	B2gATRqptaY
InChI	InChI=1S/C17H13N3O6S/c1-25-12-7-11(20(23)24)8-13-14(12)18-17(27-13)19-15(21)9-3-5-10(6-4-9)16(22)26-2/h3-8H,1-2H3,(H,18,19,21)
InChIKey	SMAKRLOAWYBMJX-UHFFFAOYSA-N Google Search
Mol Weight	387.37 g/mol
Molecular Formula	C17H13N3O6S
Exact Mass	387.052506 g/mol

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SpectraBase Spectrum ID	EoqO7N6XGE0
Name	benzoic acid, 4-[[(4-methoxy-6-nitro-2-benzothiazolyl)amino]carbonyl]-, 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/C17H13N3O6S/c1-25-12-7-11(20(23)24)8-13-14(12)18-17(27-13)19-15(21)9-3-5-10(6-4-9)16(22)26-2/h3-8H,1-2H3,(H,18,19,21)
InChIKey	SMAKRLOAWYBMJX-UHFFFAOYSA-N
NMR Offset	17.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_3472
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/10228144