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3-(4-Chloro-phenyl)-pyrimidin-4(3H)-one

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3-(4-Chloro-phenyl)-pyrimidin-4(3H)-one
SpectraBase Compound ID GNqxUMBXCmn
InChI InChI=1S/C10H7ClN2O/c11-8-1-3-9(4-2-8)13-7-12-6-5-10(13)14/h1-7H
InChIKey KJRKKNYQDGYBBX-UHFFFAOYSA-N
Mol Weight 206.63 g/mol
Molecular Formula C10H7ClN2O
Exact Mass 206.024691 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EWN074sDjiS
Name 3-(4-Chloro-phenyl)-pyrimidin-4(3H)-one
CAS Registry Number 109853-43-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H7ClN2O
InChI InChI=1S/C10H7ClN2O/c11-8-1-3-9(4-2-8)13-7-12-6-5-10(13)14/h1-7H
InChIKey KJRKKNYQDGYBBX-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