John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=BG6rTdV6wXo SpectraBase Spectrum ID=1IUdWwUq8vG

(accessed ).
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-9-iodononane
SpectraBase Compound ID BG6rTdV6wXo
InChI InChI=1S/C9H2F17I/c10-2(11,1-27)3(12,13)4(14,15)5(16,17)6(18,19)7(20,21)8(22,23)9(24,25)26/h1H2
InChIKey OTKFUZOBKMBKQN-UHFFFAOYSA-N
Mol Weight 559.99 g/mol
Molecular Formula C9H2F17I
Exact Mass 559.892982 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1IUdWwUq8vG
Name 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-9-iodononane
Compound Number 9
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H2F17I
InChI InChI=1S/C9H2F17I/c10-2(11,1-27)3(12,13)4(14,15)5(16,17)6(18,19)7(20,21)8(22,23)9(24,25)26/h1H2
InChIKey OTKFUZOBKMBKQN-UHFFFAOYSA-N
Literature Reference Author L.J.ALVEY,D.RUTHERFORD,J.J.J.JULIETTE,J.A.GLADYSZ
Literature Reference Citation J.ORG.CHEM.,63,6302(1998)
Literature Reference DOI 10.1021/jo980692y
Molecular Weight 559.992 g/mol
Sample ID 37608
Solvent CDCl3
SpectraBase Batch ID 7iRuaIzWal8