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DIISOPROPYL_2-(SULFANYLMETHYL)-PHENYLPHOSPHONATE
SpectraBase Compound ID I1At79QSkPB
InChI InChI=1S/C13H21O3PS/c1-10(2)15-17(14,16-11(3)4)13-8-6-5-7-12(13)9-18/h5-8,10-11,18H,9H2,1-4H3
InChIKey JFZVPWMZPZJUTE-UHFFFAOYSA-N
Mol Weight 288.34 g/mol
Molecular Formula C13H21O3PS
Exact Mass 288.094903 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 98nC2qVuFw9
Name DIISOPROPYL_2-(SULFANYLMETHYL)-PHENYLPHOSPHONATE
Compound Number 10A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H21O3PS
InChI InChI=1S/C13H21O3PS/c1-10(2)15-17(14,16-11(3)4)13-8-6-5-7-12(13)9-18/h5-8,10-11,18H,9H2,1-4H3
InChIKey JFZVPWMZPZJUTE-UHFFFAOYSA-N
Literature Reference Author P.LASSAUX,M.HAMEL,M.GULEA,H.DELBRUECK,P.S.MERCURI,L.HORSFALL ,D.DEHARENG,M.KUPPER
Literature Reference Citation J.MED.CHEM.,53,4862(2010)
Literature Reference DOI 10.1021/jm100213c
Solvent CDCl3
Source File Reference UWMZ40537