4-[(2E)-2-(4-{[(4-fluorophenyl)sulfonyl]oxy}benzylidene)hydrazino]benzoic acid

SpectraBase Compound ID	4ST5kNdBnoI
InChI	InChI=1S/C20H15FN2O5S/c21-16-5-11-19(12-6-16)29(26,27)28-18-9-1-14(2-10-18)13-22-23-17-7-3-15(4-8-17)20(24)25/h1-13,23H,(H,24,25)/b22-13+
InChIKey	MXJMMCBXUOCHEE-LPYMAVHISA-N Google Search
Mol Weight	414.41 g/mol
Molecular Formula	C20H15FN2O5S
Exact Mass	414.068571 g/mol

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SpectraBase Spectrum ID	1iT3yK16EMO
Name	4-[(2E)-2-(4-{[(4-fluorophenyl)sulfonyl]oxy}benzylidene)hydrazino]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/C20H15FN2O5S/c21-16-5-11-19(12-6-16)29(26,27)28-18-9-1-14(2-10-18)13-22-23-17-7-3-15(4-8-17)20(24)25/h1-13,23H,(H,24,25)/b22-13+
InChIKey	MXJMMCBXUOCHEE-LPYMAVHISA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_2998
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: D06369; Labnumber: PETROV-4024; SBI_ID: SBI-003000
Synonyms	4-[2-(4-{[(4-fluorophenyl)sulfonyl]oxy}benzylidene)hydrazino]benzoic acid
Temperature	315 °C