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7-(2-chlorobenzyl)-8-(2-cycloheptylidenehydrazino)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

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7-(2-chlorobenzyl)-8-(2-cycloheptylidenehydrazino)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID KOE18XXwSaV
InChI InChI=1S/C21H25ClN6O2/c1-26-18-17(19(29)27(2)21(26)30)28(13-14-9-7-8-12-16(14)22)20(23-18)25-24-15-10-5-3-4-6-11-15/h7-9,12H,3-6,10-11,13H2,1-2H3,(H,23,25)
InChIKey PZEJRDAOIXLPBX-UHFFFAOYSA-N
Mol Weight 428.92 g/mol
Molecular Formula C21H25ClN6O2
Exact Mass 428.172752 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EmiJ5xA8cDy
Name 7-(2-chlorobenzyl)-8-(2-cycloheptylidenehydrazino)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
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/C21H25ClN6O2/c1-26-18-17(19(29)27(2)21(26)30)28(13-14-9-7-8-12-16(14)22)20(23-18)25-24-15-10-5-3-4-6-11-15/h7-9,12H,3-6,10-11,13H2,1-2H3,(H,23,25)
InChIKey PZEJRDAOIXLPBX-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_29033
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: D90842; Labnumber: LRP02-0559; SBI_ID: SBI-029037
Temperature 308 °C