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4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-pentadecafluoro-2-iodo-capric acid methyl ester
SpectraBase Compound ID C1F9wamYW28
InChI InChI=1S/C11H6F15IO2/c1-29-4(28)3(27)2-5(12,13)6(14,15)7(16,17)8(18,19)9(20,21)10(22,23)11(24,25)26/h3H,2H2,1H3
InChIKey PQLOXCBTDPZOKM-UHFFFAOYSA-N
Mol Weight 582.05 g/mol
Molecular Formula C11H6F15IO2
Exact Mass 581.917297 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3XnDGSccBWk
Name 4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-pentadecafluoro-2-iodo-capric acid methyl ester
Alternate Name(s) 4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-pentadecafluoro-2-iododecanoic acid methyl ester Methyl 4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-pentadecafluoro-2-iodo-decanoate Methyl 4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-pentadecakis(fluoranyl)-2-iodanyl-decanoate
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Formula C11H6F15IO2
InChI InChI=1S/C11H6F15IO2/c1-29-4(28)3(27)2-5(12,13)6(14,15)7(16,17)8(18,19)9(20,21)10(22,23)11(24,25)26/h3H,2H2,1H3
InChIKey PQLOXCBTDPZOKM-UHFFFAOYSA-N
Molecular Weight 582.048 g/mol
SMILES C(C(C(C(CC(C(=O)OC)I)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F
SPLASH splash10-0a4i-9400110000-559fa0211a1e0c3b593e
Source of Spectrum J-60-3471-9
Wiley ID 1408599