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3-(Perfluoro-isohexyl)-2-iodopropyl acetate
SpectraBase Compound ID K2o7ZHgAwTp
InChI InChI=1S/C11H8F13IO2/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/h5H,2-3H2,1H3
InChIKey PUJGYKFBYNZJAQ-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 1mPBzSTNaHM
Name 3-(Perfluoro-isohexyl)-2-iodopropyl acetate
Comments Less than 3 mono-isotopic peaks
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Formula C11H8F13IO2
InChI InChI=1S/C11H8F13IO2/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/h5H,2-3H2,1H3
InChIKey PUJGYKFBYNZJAQ-UHFFFAOYSA-N
Molecular Weight 546.067 g/mol
SMILES C(C(C(CC(COC(=O)C)I)(F)F)(F)F)(C(C(F)(F)F)(C(F)(F)F)F)(F)F
SPLASH splash10-014i-0000900000-67aeb3ff6d17aa20ac9d
Source of Spectrum F9-1989-2059-0
Synonyms 4,4,5,5,6,6,7,8,8,8-decafluoro-2-iodo-7-(trifluoromethyl)octyl acetate
Wiley ID 1566103