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N-BUTYL-6-CHLORO-2-METHYLTHIO-N-NITROSO-PYRIMIDIN-4-AMINE
SpectraBase Compound ID IaxmTwnLyqA
InChI InChI=1S/C9H13ClN4OS/c1-3-4-5-14(13-15)8-6-7(10)11-9(12-8)16-2/h6H,3-5H2,1-2H3
InChIKey XSSKEHIHYXEXAL-UHFFFAOYSA-N
Mol Weight 260.74 g/mol
Molecular Formula C9H13ClN4OS
Exact Mass 260.04986 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EECrzUDbYGk
Name N-BUTYL-6-CHLORO-2-METHYLTHIO-N-NITROSO-PYRIMIDIN-4-AMINE
Compound Number 2H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H13ClN4OS
InChI InChI=1S/C9H13ClN4OS/c1-3-4-5-14(13-15)8-6-7(10)11-9(12-8)16-2/h6H,3-5H2,1-2H3
InChIKey XSSKEHIHYXEXAL-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 260.741 g/mol
Solvent CDCl3
Source File Reference UWLU77481