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METHYL-4-(N-5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-HEPTADECAFLUORODODECAN-1-YLOXY)-BENZOATE
SpectraBase Compound ID J8AU6fzKT6u
InChI InChI=1S/C20H15F17O3/c1-39-12(38)10-4-6-11(7-5-10)40-9-3-2-8-13(21,22)14(23,24)15(25,26)16(27,28)17(29,30)18(31,32)19(33,34)20(35,36)37/h4-7H,2-3,8-9H2,1H3
InChIKey JROOVOOPZXRNGW-UHFFFAOYSA-N
Mol Weight 626.31 g/mol
Molecular Formula C20H15F17O3
Exact Mass 626.074973 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F6d6gDT6nWd
Name METHYL-4-(N-5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-HEPTADECAFLUORODODECAN-1-YLOXY)-BENZOATE
Compound Number 8- 4/8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H15F17O3
InChI InChI=1S/C20H15F17O3/c1-39-12(38)10-4-6-11(7-5-10)40-9-3-2-8-13(21,22)14(23,24)15(25,26)16(27,28)17(29,30)18(31,32)19(33,34)20(35,36)37/h4-7H,2-3,8-9H2,1H3
InChIKey JROOVOOPZXRNGW-UHFFFAOYSA-N
Literature Reference Author V.PERCEC,G.JOHANSSON,G.UNGAR,J.ZHOU
Literature Reference Citation J.AM.CHEM.SOC.,118,9855(1996)
Literature Reference DOI 10.1021/ja9615738
Solvent CDCl3
Source File Reference UWLU54557