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TERT.-BUTYL-3-[ETHOXY-(3,5,6-TRICHLOROPYRIDIN-2-YLOXY)-PHOSPHOROTHIOYLAMINO]-PROPANOATE
SpectraBase Compound ID 3grlS5DzMPn
InChI InChI=1S/C14H20Cl3N2O4PS/c1-5-21-24(25,18-7-6-11(20)22-14(2,3)4)23-13-10(16)8-9(15)12(17)19-13/h8H,5-7H2,1-4H3,(H,18,25)
InChIKey KDDDKRQKQBPPIL-UHFFFAOYSA-N
Mol Weight 449.72 g/mol
Molecular Formula C14H20Cl3N2O4PS
Exact Mass 447.994698 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7B5ThxJwWFS
Name TERT.-BUTYL-3-[ETHOXY-(3,5,6-TRICHLOROPYRIDIN-2-YLOXY)-PHOSPHOROTHIOYLAMINO]-PROPANOATE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H20Cl3N2O4PS
InChI InChI=1S/C14H20Cl3N2O4PS/c1-5-21-24(25,18-7-6-11(20)22-14(2,3)4)23-13-10(16)8-9(15)12(17)19-13/h8H,5-7H2,1-4H3,(H,18,25)
InChIKey KDDDKRQKQBPPIL-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 449.717 g/mol
Solvent CDCl3
Source File Reference UWTS4195