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3-METHYLPYRIMIDIN-4-ONE
SpectraBase Compound ID Aji2HrTEdFr
InChI InChI=1S/C5H6N2O/c1-7-4-6-3-2-5(7)8/h2-4H,1H3
InChIKey PSXLJUKMMIHADB-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 9OfEGG9tNhq
Name 3-Methyl-pyrimidin-4(3H)-one
CAS Registry Number 6104-45-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C5H6N2O
InChI InChI=1S/C5H6N2O/c1-7-4-6-3-2-5(7)8/h2-4H,1H3
InChIKey PSXLJUKMMIHADB-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference G. Stajer, A.E. Szabo, G. Bernath, J. Chem. Soc. Perkin I 237 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3