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1-METHYLPYRIMIDIN-4-ONE

View entire compound with spectra: 3 NMR, and 1 MS (GC)

1-METHYLPYRIMIDIN-4-ONE
SpectraBase Compound ID FXx8dMsfCAU
InChI InChI=1S/C5H6N2O/c1-7-3-2-5(8)6-4-7/h2-4H,1H3
InChIKey NWLPRJINWFMRHH-UHFFFAOYSA-N
Mol Weight 110.12 g/mol
Molecular Formula C5H6N2O
Exact Mass 110.048013 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G3NiIr3IfYX
Name 1-METHYLPYRIMIDIN-4-ONE
Compound Number III-A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H6N2O
InChI InChI=1S/C5H6N2O/c1-7-3-2-5(8)6-4-7/h2-4H,1H3
InChIKey NWLPRJINWFMRHH-UHFFFAOYSA-N
Literature Reference Author G.M.KHEIFETS,V.A.GINDIN
Literature Reference Citation RUSS.J.ORG.CHEM.,40,560(2004)
Literature Reference DOI 10.1023/B:RUJO.0000036080.69879.b2
Molecular Weight 110.115 g/mol
Solvent DMSO-D6:D2O=96:4
Source File Reference UWMZ16759