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4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoro-2-iodo-undecanoic acid methyl ester
SpectraBase Compound ID FsvCGBwXr5
InChI InChI=1S/C12H6F17IO2/c1-32-4(31)3(30)2-5(13,14)6(15,16)7(17,18)8(19,20)9(21,22)10(23,24)11(25,26)12(27,28)29/h3H,2H2,1H3
InChIKey BBWYONAOIOUDPJ-UHFFFAOYSA-N
Mol Weight 632.06 g/mol
Molecular Formula C12H6F17IO2
Exact Mass 631.914103 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LlFLgwSbYf9
Name 4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoro-2-iodo-undecanoic acid methyl ester
Alternate Name(s) Methyl 4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoro-2-iodo-undecanoate Methyl 4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecakis(fluoranyl)-2-iodanyl-undecanoate 4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoro-2-iodoundecanoic acid methyl ester
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Formula C12H6F17IO2
InChI InChI=1S/C12H6F17IO2/c1-32-4(31)3(30)2-5(13,14)6(15,16)7(17,18)8(19,20)9(21,22)10(23,24)11(25,26)12(27,28)29/h3H,2H2,1H3
InChIKey BBWYONAOIOUDPJ-UHFFFAOYSA-N
Molecular Weight 632.055 g/mol
SMILES C(C(C(C(C(CC(C(=O)OC)I)(F)F)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F
SPLASH splash10-0a4i-9200413000-016b8cc36b19423c9a29
Source of Spectrum J-60-3471-9
Wiley ID 1412158