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6-benzoxazolamine, 2-(4-methoxyphenyl)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylidene]-
SpectraBase Compound ID 9Hzp8X6zxZt
InChI InChI=1S/C22H15N3O6/c1-28-16-5-2-13(3-6-16)22-24-17-7-4-15(9-19(17)31-22)23-11-14-8-20-21(30-12-29-20)10-18(14)25(26)27/h2-11H,12H2,1H3/b23-11+
InChIKey VRHYKYAVVWPOFQ-FOKLQQMPSA-N
Mol Weight 417.38 g/mol
Molecular Formula C22H15N3O6
Exact Mass 417.096085 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FOStj9u0opt
Name 6-benzoxazolamine, 2-(4-methoxyphenyl)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylidene]-
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/C22H15N3O6/c1-28-16-5-2-13(3-6-16)22-24-17-7-4-15(9-19(17)31-22)23-11-14-8-20-21(30-12-29-20)10-18(14)25(26)27/h2-11H,12H2,1H3/b23-11+
InChIKey VRHYKYAVVWPOFQ-FOKLQQMPSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_3402
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-205/5103370; Labnumber: BM-66370b; IOH_ID: IOH-010405