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1H-purine-2,6-dione, 7-[(2,5-dimethylphenyl)methyl]-3,7-dihydro-1,3-dimethyl-8-[(4-phenyl-1-piperazinyl)methyl]-
SpectraBase Compound ID 1VYblzKi5HI
InChI InChI=1S/C27H32N6O2/c1-19-10-11-20(2)21(16-19)17-33-23(28-25-24(33)26(34)30(4)27(35)29(25)3)18-31-12-14-32(15-13-31)22-8-6-5-7-9-22/h5-11,16H,12-15,17-18H2,1-4H3
InChIKey CHQMLRIVDJQPET-UHFFFAOYSA-N
Mol Weight 472.6 g/mol
Molecular Formula C27H32N6O2
Exact Mass 472.258674 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID gY2uAPxNZk
Name 1H-purine-2,6-dione, 7-[(2,5-dimethylphenyl)methyl]-3,7-dihydro-1,3-dimethyl-8-[(4-phenyl-1-piperazinyl)methyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 472.258674292 u
Formula C27H32N6O2
InChI InChI=1S/C27H32N6O2/c1-19-10-11-20(2)21(16-19)17-33-23(28-25-24(33)26(34)30(4)27(35)29(25)3)18-31-12-14-32(15-13-31)22-8-6-5-7-9-22/h5-11,16H,12-15,17-18H2,1-4H3
InChIKey CHQMLRIVDJQPET-UHFFFAOYSA-N
Molecular Weight 472.593 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_3777
Solvent DMSO-d6
Source Vendor ID: NMR/13279065