3,3'-(1,3,5,7-tetraoxopyrrolo[3,4-f]isoindole-2,6(1H,3H,5H,7H)-diyl)bis(2-methylbenzoic acid)

SpectraBase Compound ID	IUaeMIG6nER
InChI	InChI=1S/C26H16N2O8/c1-11-13(25(33)34)5-3-7-19(11)27-21(29)15-9-17-18(10-16(15)22(27)30)24(32)28(23(17)31)20-8-4-6-14(12(20)2)26(35)36/h3-10H,1-2H3,(H,33,34)(H,35,36)
InChIKey	QNSIKWWROXUSKX-UHFFFAOYSA-N Google Search
Mol Weight	484.42 g/mol
Molecular Formula	C26H16N2O8
Exact Mass	484.090665 g/mol

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SpectraBase Spectrum ID	5LiUPgkI9EO
Name	3,3'-(1,3,5,7-tetraoxopyrrolo[3,4-f]isoindole-2,6(1H,3H,5H,7H)-diyl)bis(2-methylbenzoic 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/C26H16N2O8/c1-11-13(25(33)34)5-3-7-19(11)27-21(29)15-9-17-18(10-16(15)22(27)30)24(32)28(23(17)31)20-8-4-6-14(12(20)2)26(35)36/h3-10H,1-2H3,(H,33,34)(H,35,36)
InChIKey	QNSIKWWROXUSKX-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_3517_1344
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/11229292