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1,3-Dimethyl-8-(2-methyl-1-piperidinyl)-7-phenacylpurine-2,6-dione

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1,3-Dimethyl-8-(2-methyl-1-piperidinyl)-7-phenacylpurine-2,6-dione
SpectraBase Compound ID 7t1feM2dPDI
InChI InChI=1S/C21H25N5O3/c1-14-9-7-8-12-25(14)20-22-18-17(19(28)24(3)21(29)23(18)2)26(20)13-16(27)15-10-5-4-6-11-15/h4-6,10-11,14H,7-9,12-13H2,1-3H3
InChIKey GTEPTPQHKXDODH-UHFFFAOYSA-N
Mol Weight 395.46 g/mol
Molecular Formula C21H25N5O3
Exact Mass 395.19574 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JA5Bbo2ySou
Name 1H-purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-8-(2-methyl-1-piperidinyl)-7-(2-oxo-2-phenylethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 395.195739682 u
Formula C21H25N5O3
InChI InChI=1S/C21H25N5O3/c1-14-9-7-8-12-25(14)20-22-18-17(19(28)24(3)21(29)23(18)2)26(20)13-16(27)15-10-5-4-6-11-15/h4-6,10-11,14H,7-9,12-13H2,1-3H3
InChIKey GTEPTPQHKXDODH-UHFFFAOYSA-N
Molecular Weight 395.463 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16430
Solvent DMSO-d6
Source Vendor ID: NMR/11270472; Lab Info: POV; Lab Number: POV-0800282