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1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-Heptadecafluoro-10-iodoicosane

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1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-Heptadecafluoro-10-iodoicosane
SpectraBase Compound ID HYFEVuVAycH
InChI InChI=1S/C20H24F17I/c1-2-3-4-5-6-7-8-9-10-12(38)11-13(21,22)14(23,24)15(25,26)16(27,28)17(29,30)18(31,32)19(33,34)20(35,36)37/h12H,2-11H2,1H3
InChIKey KDNAFMKMUXWOIX-UHFFFAOYSA-N
Mol Weight 714.29 g/mol
Molecular Formula C20H24F17I
Exact Mass 714.065125 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L1RC2LEvcy8
Name 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-Heptadecafluoro-10-iodoicosane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 714.065124544 u
Formula C20H24F17I
InChI InChI=1S/C20H24F17I/c1-2-3-4-5-6-7-8-9-10-12(38)11-13(21,22)14(23,24)15(25,26)16(27,28)17(29,30)18(31,32)19(33,34)20(35,36)37/h12H,2-11H2,1H3
InChIKey KDNAFMKMUXWOIX-UHFFFAOYSA-N
Molecular Weight 714.289 g/mol
SMILES C(C(C(C(C(C(C(C(CC(CCCCCCCCCC)I)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)(F)F