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1-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)-2-(piperidin-1-yl)propan-2-ylium chloride
SpectraBase Compound ID JZ4aSVCuMTV
InChI InChI=1S/C14H20N6O2.ClH/c1-17-12-11(13(21)18(2)14(17)22)20(9-16-12)8-10(15)19-6-4-3-5-7-19;/h9,15H,3-8H2,1-2H3;1H
InChIKey IVTWNYUAQLEMMW-UHFFFAOYSA-N
Mol Weight 340.81 g/mol
Molecular Formula C14H21ClN6O2
Exact Mass 340.141452 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID kIu1ELNsZv
Name 1-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)-2-(piperidin-1-yl)propan-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 340.141451638 u
Formula C14H21ClN6O2
InChI InChI=1S/C14H20N6O2.ClH/c1-17-12-11(13(21)18(2)14(17)22)20(9-16-12)8-10(15)19-6-4-3-5-7-19;/h9,15H,3-8H2,1-2H3;1H
InChIKey IVTWNYUAQLEMMW-UHFFFAOYSA-N
Molecular Weight 340.815 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14693
Solvent DMSO-d6
Source Vendor ID: NMR/10260874; Lab Info: BEV; Lab Number: BEV-0000061