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1H-isoindole-1,3(2H)-dione, 2-[3-(2-benzothiazolyl)phenyl]-5-nitro-
SpectraBase Compound ID BDe6DLAdUJc
InChI InChI=1S/C21H11N3O4S/c25-20-15-9-8-14(24(27)28)11-16(15)21(26)23(20)13-5-3-4-12(10-13)19-22-17-6-1-2-7-18(17)29-19/h1-11H
InChIKey IOCISPPUFWCWBO-UHFFFAOYSA-N
Mol Weight 401.4 g/mol
Molecular Formula C21H11N3O4S
Exact Mass 401.047027 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ER951LFYvlR
Name 1H-isoindole-1,3(2H)-dione, 2-[3-(2-benzothiazolyl)phenyl]-5-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/C21H11N3O4S/c25-20-15-9-8-14(24(27)28)11-16(15)21(26)23(20)13-5-3-4-12(10-13)19-22-17-6-1-2-7-18(17)29-19/h1-11H
InChIKey IOCISPPUFWCWBO-UHFFFAOYSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_2913
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/10218639