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3-(Perfluoro-isohexyl)-2-iodoprop-2-enyl acetate
SpectraBase Compound ID 1ClSukY4qKS
InChI InChI=1S/C11H6F13IO2/c1-4(26)27-3-5(25)2-6(12,13)8(15,16)9(17,18)7(14,10(19,20)21)11(22,23)24/h2H,3H2,1H3/b5-2-
InChIKey HBNFWHJWFAARSO-DJWKRKHSSA-N
Mol Weight 544.05 g/mol
Molecular Formula C11H6F13IO2
Exact Mass 543.920491 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FKDz0Dykz6L
Name 3-(Perfluoro-isohexyl)-2-iodoprop-2-enyl acetate
Alternate Name(s) (2Z)-4,4,5,5,6,6,7,8,8,8-decafluoro-2-iodo-7-(trifluoromethyl)-2-octenyl acetate
Comments Less than 3 mono-isotopic peaks
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Formula C11H6F13IO2
InChI InChI=1S/C11H6F13IO2/c1-4(26)27-3-5(25)2-6(12,13)8(15,16)9(17,18)7(14,10(19,20)21)11(22,23)24/h2H,3H2,1H3/b5-2-
InChIKey HBNFWHJWFAARSO-DJWKRKHSSA-N
Molecular Weight 544.051 g/mol
SMILES C(C(C(\C=C\(COC(=O)C)I)(F)F)(F)F)(C(C(F)(F)F)(C(F)(F)F)F)(F)F
SPLASH splash10-014i-0000900000-3649f64d904c4fcbd21d
Source of Spectrum F9-1989-2059-0
Wiley ID 1566101