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3-bromo-4-hydroxy-5-methoxybenzaldehyde [7-(2-hydroxyethyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazone

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3-bromo-4-hydroxy-5-methoxybenzaldehyde [7-(2-hydroxyethyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazone
SpectraBase Compound ID 1bs6MFhCGgF
InChI InChI=1S/C16H17BrN6O5/c1-22-13-11(14(26)20-16(22)27)23(3-4-24)15(19-13)21-18-7-8-5-9(17)12(25)10(6-8)28-2/h5-7,24-25H,3-4H2,1-2H3,(H,19,21)(H,20,26,27)/b18-7+
InChIKey BAPFPISIDAZNIT-CNHKJKLMSA-N
Mol Weight 453.25 g/mol
Molecular Formula C16H17BrN6O5
Exact Mass 452.044381 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FXJ2NkazqqT
Name 3-bromo-4-hydroxy-5-methoxybenzaldehyde [7-(2-hydroxyethyl)-3-methyl-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/C16H17BrN6O5/c1-22-13-11(14(26)20-16(22)27)23(3-4-24)15(19-13)21-18-7-8-5-9(17)12(25)10(6-8)28-2/h5-7,24-25H,3-4H2,1-2H3,(H,19,21)(H,20,26,27)/b18-7+
InChIKey BAPFPISIDAZNIT-CNHKJKLMSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25067
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: D49488; Labnumber: UZROM-3831; SBI_ID: SBI-025071
Temperature 308 °C