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METHYL-2-(DIMETHOXYPHOSPHORYL)-4,4-BIS-(TRIFLUOROMETHYLSULFONYL)-BUTANOATE
SpectraBase Compound ID 6qotLMUzCx9
InChI InChI=1S/C9H13F6O9PS2/c1-22-7(16)5(25(17,23-2)24-3)4-6(26(18,19)8(10,11)12)27(20,21)9(13,14)15/h5-6H,4H2,1-3H3
InChIKey HKCIXQRJUCSWTM-UHFFFAOYSA-N
Mol Weight 474.28 g/mol
Molecular Formula C9H13F6O9PS2
Exact Mass 473.96428 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JR6lBRnhuYW
Name METHYL-2-(DIMETHOXYPHOSPHORYL)-4,4-BIS-(TRIFLUOROMETHYLSULFONYL)-BUTANOATE
Compound Number 4D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H13F6O9PS2
InChI InChI=1S/C9H13F6O9PS2/c1-22-7(16)5(25(17,23-2)24-3)4-6(26(18,19)8(10,11)12)27(20,21)9(13,14)15/h5-6H,4H2,1-3H3
InChIKey HKCIXQRJUCSWTM-UHFFFAOYSA-N
Literature Reference Author H.YANAI,M.FUJITA,A.TAKAHASHI,M.ZHANG,M.MISHIMA,A.KOTANI,T.MA TSUMOTO,T.TAGUCHI
Literature Reference Citation MOLECULES,18,15531(2013)
Literature Reference DOI 10.3390/molecules181215531
Solvent CDCl3
Source File Reference UWIR10001