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3-[1,3-dimethyl-8-(4-morpholinyl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]propanenitrile
SpectraBase Compound ID 56c0LXotAi0
InChI InChI=1S/C14H18N6O3/c1-17-11-10(12(21)18(2)14(17)22)20(5-3-4-15)13(16-11)19-6-8-23-9-7-19/h3,5-9H2,1-2H3
InChIKey MQTXDDWOXDUGJU-UHFFFAOYSA-N
Mol Weight 318.34 g/mol
Molecular Formula C14H18N6O3
Exact Mass 318.144038 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID En9LtI9sSbw
Name 3-[1,3-dimethyl-8-(4-morpholinyl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]propanenitrile
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C14H18N6O3/c1-17-11-10(12(21)18(2)14(17)22)20(5-3-4-15)13(16-11)19-6-8-23-9-7-19/h3,5-9H2,1-2H3
InChIKey MQTXDDWOXDUGJU-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25046
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D49455; Labnumber: UZROM-3779; SBI_ID: SBI-025050
Temperature 308 °C