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4-methylbenzaldehyde [3-methyl-7-(4-methylbenzyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazone
SpectraBase Compound ID IAv6ZWDYdIG
InChI InChI=1S/C22H22N6O2/c1-14-4-8-16(9-5-14)12-23-26-21-24-19-18(20(29)25-22(30)27(19)3)28(21)13-17-10-6-15(2)7-11-17/h4-12H,13H2,1-3H3,(H,24,26)(H,25,29,30)/b23-12+
InChIKey MKSNBRGATMYOJE-FSJBWODESA-N
Mol Weight 402.46 g/mol
Molecular Formula C22H22N6O2
Exact Mass 402.180424 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7FKtnOMAHrs
Name 4-methylbenzaldehyde [3-methyl-7-(4-methylbenzyl)-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/C22H22N6O2/c1-14-4-8-16(9-5-14)12-23-26-21-24-19-18(20(29)25-22(30)27(19)3)28(21)13-17-10-6-15(2)7-11-17/h4-12H,13H2,1-3H3,(H,24,26)(H,25,29,30)/b23-12+
InChIKey MKSNBRGATMYOJE-FSJBWODESA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20170
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: D16342; Labnumber: UZROM-3453; SBI_ID: SBI-020174
Temperature 318 °C