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5-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)-2-(piperidin-1-yl)pentan-2-ylium chloride

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5-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)-2-(piperidin-1-yl)pentan-2-ylium chloride
SpectraBase Compound ID 1LxC2Yc12nh
InChI InChI=1S/C16H24N6O2.ClH/c1-19-14-13(15(23)20(2)16(19)24)22(11-18-14)10-6-7-12(17)21-8-4-3-5-9-21;/h11,17H,3-10H2,1-2H3;1H
InChIKey CIBRKDRRFFKBJI-UHFFFAOYSA-N
Mol Weight 368.87 g/mol
Molecular Formula C16H25ClN6O2
Exact Mass 368.172752 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GOTCQSKKiLs
Name 5-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)-2-(piperidin-1-yl)pentan-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 368.172751767 u
Formula C16H25ClN6O2
InChI InChI=1S/C16H24N6O2.ClH/c1-19-14-13(15(23)20(2)16(19)24)22(11-18-14)10-6-7-12(17)21-8-4-3-5-9-21;/h11,17H,3-10H2,1-2H3;1H
InChIKey CIBRKDRRFFKBJI-UHFFFAOYSA-N
Molecular Weight 368.869 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14208
Solvent DMSO-d6
Source Vendor ID: NMR/10260881; Lab Info: BEV; Lab Number: BEV-0000068