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N-(4-METHOXYPHENETHYL)-2-METHYLTHIO-6-MORPHOLINO-5-NITROSO-PYRIMIDIN-4-AMINE

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N-(4-METHOXYPHENETHYL)-2-METHYLTHIO-6-MORPHOLINO-5-NITROSO-PYRIMIDIN-4-AMINE
SpectraBase Compound ID FHFGga2gXtT
InChI InChI=1S/C18H23N5O3S/c1-25-14-5-3-13(4-6-14)7-8-19-16-15(22-24)17(21-18(20-16)27-2)23-9-11-26-12-10-23/h3-6H,7-12H2,1-2H3,(H,19,20,21)
InChIKey KKNHCLCVUJNYIL-UHFFFAOYSA-N
Mol Weight 389.47 g/mol
Molecular Formula C18H23N5O3S
Exact Mass 389.152161 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3a2R0BmFxeT
Name N-(4-METHOXYPHENETHYL)-2-METHYLTHIO-6-MORPHOLINO-5-NITROSO-PYRIMIDIN-4-AMINE
Compound Number 6GA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H23N5O3S
InChI InChI=1S/C18H23N5O3S/c1-25-14-5-3-13(4-6-14)7-8-19-16-15(22-24)17(21-18(20-16)27-2)23-9-11-26-12-10-23/h3-6H,7-12H2,1-2H3,(H,19,20,21)
InChIKey KKNHCLCVUJNYIL-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 389.472 g/mol
Solvent CDCl3
Source File Reference UWLU77492