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1H-pyrazole-3-acetonitrile, 5-amino-alpha-[[3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]methylene]-4-cyano-1-phenyl-
SpectraBase Compound ID Lu52IPjjBnp
InChI InChI=1S/C22H15BrN6O2/c1-30-19-11-14(10-18(23)21(19)31-8-7-24)9-15(12-25)20-17(13-26)22(27)29(28-20)16-5-3-2-4-6-16/h2-6,9-11H,8,27H2,1H3/b15-9+
InChIKey DZHYVGPHUIUGSJ-OQLLNIDSSA-N
Mol Weight 475.31 g/mol
Molecular Formula C22H15BrN6O2
Exact Mass 474.043987 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Lgxpe39EA7G
Name 1H-pyrazole-3-acetonitrile, 5-amino-alpha-[[3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]methylene]-4-cyano-1-phenyl-
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/C22H15BrN6O2/c1-30-19-11-14(10-18(23)21(19)31-8-7-24)9-15(12-25)20-17(13-26)22(27)29(28-20)16-5-3-2-4-6-16/h2-6,9-11H,8,27H2,1H3/b15-9+
InChIKey DZHYVGPHUIUGSJ-OQLLNIDSSA-N
NMR Offset 16.2999
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_CB_8313_2275
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/9248383
Temperature 303 °C