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4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluoro-2-iodo-pelargonic acid ethyl ester
SpectraBase Compound ID DtuWgjhyx4s
InChI InChI=1S/C11H8F13IO2/c1-2-27-5(26)4(25)3-6(12,13)7(14,15)8(16,17)9(18,19)10(20,21)11(22,23)24/h4H,2-3H2,1H3
InChIKey JGUVWYUPMQRWNA-UHFFFAOYSA-N
Mol Weight 546.07 g/mol
Molecular Formula C11H8F13IO2
Exact Mass 545.936141 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID p4jAd4sKlo
Name 4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluoro-2-iodo-pelargonic acid ethyl ester
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Formula C11H8F13IO2
InChI InChI=1S/C11H8F13IO2/c1-2-27-5(26)4(25)3-6(12,13)7(14,15)8(16,17)9(18,19)10(20,21)11(22,23)24/h4H,2-3H2,1H3
InChIKey JGUVWYUPMQRWNA-UHFFFAOYSA-N
Molecular Weight 546.067 g/mol
SMILES C(C(C(C(F)(F)F)(F)F)(F)F)(C(C(CC(C(=O)OCC)I)(F)F)(F)F)(F)F
SPLASH splash10-0adi-9406210000-1f8d2fe8aa12b1219cc4
Source of Spectrum J-60-3469-3
Synonyms Ethyl 2-iodo-3-perfluorohexylpropanoate 4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluoro-2-iodononanoic acid ethyl ester Ethyl 4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluoro-2-iodononanoate Ethyl 4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluoro-2-iodo-nonanoate Ethyl 4,4,5,5,6,6,7,7,8,8,9,9,9-tridecakis(fluoranyl)-2-iodanyl-nonanoate
Wiley ID 1405179