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4-methoxybenzaldehyde [7-(4-bromobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazone
SpectraBase Compound ID K1gn9J627tl
InChI InChI=1S/C22H21BrN6O3/c1-27-19-18(20(30)28(2)22(27)31)29(13-15-4-8-16(23)9-5-15)21(25-19)26-24-12-14-6-10-17(32-3)11-7-14/h4-12H,13H2,1-3H3,(H,25,26)/b24-12+
InChIKey GBXNZMCAKSVZBL-WYMPLXKRSA-N
Mol Weight 497.35 g/mol
Molecular Formula C22H21BrN6O3
Exact Mass 496.085852 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KpHMA4CxY4u
Name 4-methoxybenzaldehyde [7-(4-bromobenzyl)-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/C22H21BrN6O3/c1-27-19-18(20(30)28(2)22(27)31)29(13-15-4-8-16(23)9-5-15)21(25-19)26-24-12-14-6-10-17(32-3)11-7-14/h4-12H,13H2,1-3H3,(H,25,26)/b24-12+
InChIKey GBXNZMCAKSVZBL-WYMPLXKRSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_9620
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: D55529; Labnumber: LRP02-0609; SBI_ID: SBI-009623
Temperature 318 °C