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1-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)-2,4-dimethylpentan-2-ylium chloride
SpectraBase Compound ID DCfa6KrvJoZ
InChI InChI=1S/C12H18N6O2.ClH/c1-7(2)15-8(13)5-18-6-14-10-9(18)11(19)17(4)12(20)16(10)3;/h6-7H,5H2,1-4H3,(H2,13,15);1H
InChIKey DPLPLTHANZAELX-UHFFFAOYSA-N
Mol Weight 314.78 g/mol
Molecular Formula C12H19ClN6O2
Exact Mass 314.125802 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3yEuTi3suGC
Name 1-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)-2,4-dimethylpentan-2-ylium chloride
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 314.125801574 u
Formula C12H19ClN6O2
InChI InChI=1S/C12H18N6O2.ClH/c1-7(2)15-8(13)5-18-6-14-10-9(18)11(19)17(4)12(20)16(10)3;/h6-7H,5H2,1-4H3,(H2,13,15);1H
InChIKey DPLPLTHANZAELX-UHFFFAOYSA-N
Molecular Weight 314.777 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14207
Solvent DMSO-d6
Source Vendor ID: NMR/10260876; Lab Info: BEV; Lab Number: BEV-0000063