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4-Ethoxy-2,6-bis(methylthio)-5-octylpyrimidine

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4-Ethoxy-2,6-bis(methylthio)-5-octylpyrimidine
SpectraBase Compound ID 8FxwrEStxut
InChI InChI=1S/C16H28N2OS2/c1-5-7-8-9-10-11-12-13-14(19-6-2)17-16(21-4)18-15(13)20-3/h5-12H2,1-4H3
InChIKey KLKIIWASVJXLHK-UHFFFAOYSA-N
Mol Weight 328.53 g/mol
Molecular Formula C16H28N2OS2
Exact Mass 328.164306 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1VgR0j6gzvY
Name 4-ETHOXY-2,6-BIS-(METHYLTHIO)-5-OCTYLPYRIMIDINE
Compound Number 4D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H28N2OS2
InChI InChI=1S/C16H28N2OS2/c1-5-7-8-9-10-11-12-13-14(19-6-2)17-16(21-4)18-15(13)20-3/h5-12H2,1-4H3
InChIKey KLKIIWASVJXLHK-UHFFFAOYSA-N
Literature Reference Author A.HERRERA,R.MARTINEZ-ALVAREZ,P.RAMIRO,J.ALMY,D.MOLERO,A.SANC HEZ
Literature Reference Citation EUR.J.ORG.CHEM.,3332(2006)
Molecular Weight 328.531 g/mol
Sample ID 32583
Solvent CDCl3