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acetic acid [2-(acetoxymethyl)-3-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecoxy)-2-methyl-propyl] ester
SpectraBase Compound ID 6dD6ki7z6ag
InChI InChI=1S/C20H21F17O5/c1-10(38)41-8-12(3,9-42-11(2)39)7-40-6-4-5-13(21,22)14(23,24)15(25,26)16(27,28)17(29,30)18(31,32)19(33,34)20(35,36)37/h4-9H2,1-3H3
InChIKey ZOTBBIXSVFPVRB-UHFFFAOYSA-N
Mol Weight 664.36 g/mol
Molecular Formula C20H21F17O5
Exact Mass 664.111753 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7lgcPMprGSR
Name acetic acid [2-(acetoxymethyl)-3-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecoxy)-2-methyl-propyl] ester
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H21F17O5
InChI InChI=1S/C20H21F17O5/c1-10(38)41-8-12(3,9-42-11(2)39)7-40-6-4-5-13(21,22)14(23,24)15(25,26)16(27,28)17(29,30)18(31,32)19(33,34)20(35,36)37/h4-9H2,1-3H3
InChIKey ZOTBBIXSVFPVRB-UHFFFAOYSA-N
Literature Reference Author B.A.OMOTOWA,M.R.JUDD,B.TWAMLEY,J.M.SHREEVE
Literature Reference Citation J.ORG.CHEM.,67,1588(2002)
Literature Reference DOI 10.1021/jo016166f
Molecular Weight 664.357 g/mol
Solvent CDCl3
Source File Reference UWMS23384