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MYQIRRKOZMOBNI-JXZCOENLSA-N
SpectraBase Compound ID 1uP7lJhfKq7
InChI InChI=1S/C27H40F9N2O5PS2/c1-23(2,3)21(37-43-46(41,42)27(34,35)36)15-44(19-10-8-7-9-11-19)16-22(24(4,5)6)38-45(39,40)20-13-17(25(28,29)30)12-18(14-20)26(31,32)33/h12-14,19,21-22,37-38H,7-11,15-16H2,1-6H3/t21-,22-,44?/m1/s1
InChIKey MYQIRRKOZMOBNI-JXZCOENLSA-N
Mol Weight 738.7 g/mol
Molecular Formula C27H40F9N2O5PS2
Exact Mass 738.197255 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID sODXdPIc4A
Name MYQIRRKOZMOBNI-JXZCOENLSA-N
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H40F9N2O5PS2
InChI InChI=1S/C27H40F9N2O5PS2/c1-23(2,3)21(37-43-46(41,42)27(34,35)36)15-44(19-10-8-7-9-11-19)16-22(24(4,5)6)38-45(39,40)20-13-17(25(28,29)30)12-18(14-20)26(31,32)33/h12-14,19,21-22,37-38H,7-11,15-16H2,1-6H3/t21-,22-,44?/m1/s1
InChIKey MYQIRRKOZMOBNI-JXZCOENLSA-N
Literature Reference Author A.P.DUNCAN,J.L.LEIGHTON
Literature Reference Citation ORG.LETTERS,6,4117(2004)
Literature Reference DOI 10.1021/ol048191o
Solvent CDCl3
Source File Reference UWLU50164