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TERT.-BUTYL-3-[2-(DIETHYLAMINO)-6-METHYLPYRIMIDIN-4-YLOXY-(METHOXY)-PHOSPHOROTHIOYLAMINO]-PROPANOATE
SpectraBase Compound ID 44ZHDUXR5MD
InChI InChI=1S/C17H31N4O4PS/c1-8-21(9-2)16-19-13(3)12-14(20-16)25-26(27,23-7)18-11-10-15(22)24-17(4,5)6/h12H,8-11H2,1-7H3,(H,18,27)
InChIKey QSCKPNYLEMFURU-UHFFFAOYSA-N
Mol Weight 418.49 g/mol
Molecular Formula C17H31N4O4PS
Exact Mass 418.180364 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9uHcFVGy8Rg
Name TERT.-BUTYL-3-[2-(DIETHYLAMINO)-6-METHYLPYRIMIDIN-4-YLOXY-(METHOXY)-PHOSPHOROTHIOYLAMINO]-PROPANOATE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H31N4O4PS
InChI InChI=1S/C17H31N4O4PS/c1-8-21(9-2)16-19-13(3)12-14(20-16)25-26(27,23-7)18-11-10-15(22)24-17(4,5)6/h12H,8-11H2,1-7H3,(H,18,27)
InChIKey QSCKPNYLEMFURU-UHFFFAOYSA-N
Literature Reference Author D.P.MCADAM,J.H.SKERRITT
Literature Reference Citation AUSTR.J.CHEM.,46,959(1993)
Literature Reference DOI 10.1071/ch9930959
Molecular Weight 418.491 g/mol
Solvent CDCl3
Source File Reference UWTS4199