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4-methoxybenzaldehyde [7-(4-chlorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazone
SpectraBase Compound ID 2YYxIwhsvjz
InChI InChI=1S/C22H21ClN6O3/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 PXAGJDHOUZMVPE-WYMPLXKRSA-N
Mol Weight 452.9 g/mol
Molecular Formula C22H21ClN6O3
Exact Mass 452.136366 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID APkhZXauSp
Name 4-methoxybenzaldehyde [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/C22H21ClN6O3/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 PXAGJDHOUZMVPE-WYMPLXKRSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20193
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: D16372; Labnumber: UZROM-3493; SBI_ID: SBI-020197
Temperature 318 °C