benzoic acid, 4-[(2-methylphenyl)thio]-3-nitro-

SpectraBase Compound ID	JuyZ4JpoTF9
InChI	InChI=1S/C14H11NO4S/c1-9-4-2-3-5-12(9)20-13-7-6-10(14(16)17)8-11(13)15(18)19/h2-8H,1H3,(H,16,17)
InChIKey	HXAMNVUCVOWPRU-UHFFFAOYSA-N Google Search
Mol Weight	289.31 g/mol
Molecular Formula	C14H11NO4S
Exact Mass	289.040879 g/mol

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SpectraBase Spectrum ID	CsygTKCnI4f
Name	benzoic acid, 4-[(2-methylphenyl)thio]-3-nitro-
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/C14H11NO4S/c1-9-4-2-3-5-12(9)20-13-7-6-10(14(16)17)8-11(13)15(18)19/h2-8H,1H3,(H,16,17)
InChIKey	HXAMNVUCVOWPRU-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_6914
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/10321618; Labnumber: LP-2101742