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DIISOPROPYL_ALPHA-HYDROXY-THIOCYANATO-(2,4-DICHLOROBENZYL)-PHOSPHONATE
SpectraBase Compound ID BywzF6H4nKF
InChI InChI=1S/C14H18Cl2NO3PS/c1-9(2)19-21(18,20-10(3)4)14(22-8-17)12-6-5-11(15)7-13(12)16/h5-7,9-10,14H,1-4H3
InChIKey ZOUTUNNHBZTWJJ-UHFFFAOYSA-N
Mol Weight 382.24 g/mol
Molecular Formula C14H18Cl2NO3PS
Exact Mass 381.012207 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L1VSrXuMGnA
Name DIISOPROPYL_ALPHA-HYDROXY-THIOCYANATO-(2,4-DICHLOROBENZYL)-PHOSPHONATE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H18Cl2NO3PS
InChI InChI=1S/C14H18Cl2NO3PS/c1-9(2)19-21(18,20-10(3)4)14(22-8-17)12-6-5-11(15)7-13(12)16/h5-7,9-10,14H,1-4H3
InChIKey ZOUTUNNHBZTWJJ-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 UWMZ40540