1H-isoindole-1,3(2H)-dione, 2-[[5-[(4,7-dimethoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-3-isoxazolyl]methyl]-

SpectraBase Compound ID	2qwEfuSmwm2
InChI	InChI=1S/C22H20N2O7/c1-27-17-8-12(18(28-2)20-19(17)29-11-30-20)7-14-9-13(23-31-14)10-24-21(25)15-5-3-4-6-16(15)22(24)26/h3-6,8,14H,7,9-11H2,1-2H3
InChIKey	OEEODOWTZOVRDY-UHFFFAOYSA-N Google Search
Mol Weight	424.41 g/mol
Molecular Formula	C22H20N2O7
Exact Mass	424.127051 g/mol

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SpectraBase Spectrum ID	KJhrFyQvWWR
Name	1H-isoindole-1,3(2H)-dione, 2-[[5-[(4,7-dimethoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-3-isoxazolyl]methyl]-
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/C22H20N2O7/c1-27-17-8-12(18(28-2)20-19(17)29-11-30-20)7-14-9-13(23-31-14)10-24-21(25)15-5-3-4-6-16(15)22(24)26/h3-6,8,14H,7,9-11H2,1-2H3
InChIKey	OEEODOWTZOVRDY-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7529_5078
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/17311247; Labnumber: 92