benzoic acid, 3-iodo-, 3-[(3-iodobenzoyl)oxy]-2-methylphenyl ester

SpectraBase Compound ID	T8tUaJMyWJ
InChI	InChI=1S/C21H14I2O4/c1-13-18(26-20(24)14-5-2-7-16(22)11-14)9-4-10-19(13)27-21(25)15-6-3-8-17(23)12-15/h2-12H,1H3
InChIKey	LQAAOEHHPAKKMG-UHFFFAOYSA-N Google Search
Mol Weight	584.15 g/mol
Molecular Formula	C21H14I2O4
Exact Mass	583.898149 g/mol

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SpectraBase Spectrum ID	Ku2huPbDoV2
Name	benzoic acid, 3-iodo-, 3-[(3-iodobenzoyl)oxy]-2-methylphenyl 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/C21H14I2O4/c1-13-18(26-20(24)14-5-2-7-16(22)11-14)9-4-10-19(13)27-21(25)15-6-3-8-17(23)12-15/h2-12H,1H3
InChIKey	LQAAOEHHPAKKMG-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_8516_4709
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: AG-205/5051363; Labnumber: AI-9102; IOH_ID: IOH-011712