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2-{[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylidene]amino}benzonitrile
SpectraBase Compound ID 1CEpCovZ2Qe
InChI InChI=1S/C15H9N3O4/c16-7-10-3-1-2-4-12(10)17-8-11-5-14-15(22-9-21-14)6-13(11)18(19)20/h1-6,8H,9H2/b17-8+
InChIKey WSLDEPHDUVVRNF-CAOOACKPSA-N
Mol Weight 295.25 g/mol
Molecular Formula C15H9N3O4
Exact Mass 295.059306 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BupSZujLbDY
Name 2-{[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylidene]amino}benzonitrile
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/C15H9N3O4/c16-7-10-3-1-2-4-12(10)17-8-11-5-14-15(22-9-21-14)6-13(11)18(19)20/h1-6,8H,9H2/b17-8+
InChIKey WSLDEPHDUVVRNF-CAOOACKPSA-N
NMR Offset 15.2038
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_2518
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: ZI/6072426; Labnumber: SMN-0099679; IOH_ID: IOH-002519
Synonyms 2-{[(6-nitro-1,3-benzodioxol-5-yl)methylidene]amino}benzonitrile
Temperature 313 °C