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5-bromo-2-hydroxybenzaldehyde [7-(4-chlorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazone
SpectraBase Compound ID C89NcAMtUe9
InChI InChI=1S/C21H18BrClN6O3/c1-27-18-17(19(31)28(2)21(27)32)29(11-12-3-6-15(23)7-4-12)20(25-18)26-24-10-13-9-14(22)5-8-16(13)30/h3-10,30H,11H2,1-2H3,(H,25,26)/b24-10+
InChIKey MCPHCGOKUWPQGS-YSURURNPSA-N
Mol Weight 517.77 g/mol
Molecular Formula C21H18BrClN6O3
Exact Mass 516.031229 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7j3ySfy6XAJ
Name 5-bromo-2-hydroxybenzaldehyde [7-(4-chlorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazone
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/C21H18BrClN6O3/c1-27-18-17(19(31)28(2)21(27)32)29(11-12-3-6-15(23)7-4-12)20(25-18)26-24-10-13-9-14(22)5-8-16(13)30/h3-10,30H,11H2,1-2H3,(H,25,26)/b24-10+
InChIKey MCPHCGOKUWPQGS-YSURURNPSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20203
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: D16384; Labnumber: UZROM-3506; SBI_ID: SBI-020207
Temperature 318 °C