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XXMCEBMUNMYQIS-MQQKCMAXSA-N

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XXMCEBMUNMYQIS-MQQKCMAXSA-N
SpectraBase Compound ID KvJcxwiT1PS
InChI InChI=1S/C13H14F6O4/c1-2-3-4-5-6-9(10(20)22-7-12(14,15)16)11(21)23-8-13(17,18)19/h2-5,9H,6-8H2,1H3/b3-2+,5-4+
InChIKey XXMCEBMUNMYQIS-MQQKCMAXSA-N
Mol Weight 348.24 g/mol
Molecular Formula C13H14F6O4
Exact Mass 348.079628 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5VxG2G6DIQC
Name XXMCEBMUNMYQIS-MQQKCMAXSA-N
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14F6O4
InChI InChI=1S/C13H14F6O4/c1-2-3-4-5-6-9(10(20)22-7-12(14,15)16)11(21)23-8-13(17,18)19/h2-5,9H,6-8H2,1H3/b3-2+,5-4+
InChIKey XXMCEBMUNMYQIS-MQQKCMAXSA-N
Literature Reference Author J.M.TAKACS,Z.XU,X.T.JIANG,A.P.LEONOV,G.C.THERIOT
Literature Reference Citation ORG.LETTERS,4,3843(2002)
Literature Reference DOI 10.1021/ol0266626
Molecular Weight 348.242 g/mol
Sample ID 33039
Solvent CDCl3