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N-[4-[BENZYL-(NITROSO)-AMINO]-6-CHLOROPYRIMIDIN-2-YL]-ACETAMIDE
SpectraBase Compound ID KnUghniuTNW
InChI InChI=1S/C13H12ClN5O2/c1-9(20)15-13-16-11(14)7-12(17-13)19(18-21)8-10-5-3-2-4-6-10/h2-7H,8H2,1H3,(H,15,16,17,20)
InChIKey ILWALYHCXLRJOS-UHFFFAOYSA-N
Mol Weight 305.73 g/mol
Molecular Formula C13H12ClN5O2
Exact Mass 305.067952 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CPRNhFs0OlA
Name N-[4-[BENZYL-(NITROSO)-AMINO]-6-CHLOROPYRIMIDIN-2-YL]-ACETAMIDE
Compound Number 2J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H12ClN5O2
InChI InChI=1S/C13H12ClN5O2/c1-9(20)15-13-16-11(14)7-12(17-13)19(18-21)8-10-5-3-2-4-6-10/h2-7H,8H2,1H3,(H,15,16,17,20)
InChIKey ILWALYHCXLRJOS-UHFFFAOYSA-N
Literature Reference Author I.CIKOTIENE,M.JONUSIS,V.JAKUBKIENE
Literature Reference Citation BEIL.J.ORG.CHEM.,9,1819(2013)
Literature Reference DOI 10.3762/bjoc.9.212
Molecular Weight 305.724 g/mol
Solvent DMSO-D6
Source File Reference UWLU77483