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4-Bromanyl-2-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecakis(fluoranyl)octyl]phenol
SpectraBase Compound ID Ba7l7RoEB1N
InChI InChI=1S/C14H4BrF17O/c15-4-1-2-6(33)5(3-4)7(16,17)8(18,19)9(20,21)10(22,23)11(24,25)12(26,27)13(28,29)14(30,31)32/h1-3,33H
InChIKey VZCQZRKNFJMQDM-UHFFFAOYSA-N
Mol Weight 591.06 g/mol
Molecular Formula C14H4BrF17O
Exact Mass 589.917407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2GcNLzmNoO
Name 4-Bromanyl-2-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecakis(fluoranyl)octyl]phenol
Alternate Name(s) 4-Bromo-2-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)phenol
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Formula C14H4BrF17O
InChI InChI=1S/C14H4BrF17O/c15-4-1-2-6(33)5(3-4)7(16,17)8(18,19)9(20,21)10(22,23)11(24,25)12(26,27)13(28,29)14(30,31)32/h1-3,33H
InChIKey VZCQZRKNFJMQDM-UHFFFAOYSA-N
Molecular Weight 591.062 g/mol
SMILES Oc1c(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)cc(cc1)Br
SPLASH splash10-00di-2290080000-c3c89f54abda32ad2144
Source of Spectrum AT-40-3887-0
Wiley ID 854551