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(E)-2,3,4,4,5,5,6,6,7,7,7-undecafluoro-1-(4-fluorophenyl)-2-hepten-1-one
SpectraBase Compound ID CQEChPxRdR0
InChI InChI=1S/C13H4F12O/c14-6-3-1-5(2-4-6)8(26)7(15)9(16)10(17,18)11(19,20)12(21,22)13(23,24)25/h1-4H/b9-7+
InChIKey KEFZTBVDCHURBP-VQHVLOKHSA-N
Mol Weight 404.15 g/mol
Molecular Formula C13H4F12O
Exact Mass 404.007053 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EYzMEY1orRO
Name (E)-2,3,4,4,5,5,6,6,7,7,7-undecafluoro-1-(4-fluorophenyl)-2-hepten-1-one
Alternate Name(s) (E)-2,3,4,4,5,5,6,6,7,7,7-undecafluoro-1-(4-fluorophenyl)hept-2-en-1-one (E)-2,3,4,4,5,5,6,6,7,7,7-undecakis(fluoranyl)-1-(4-fluorophenyl)hept-2-en-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C13H4F12O
InChI InChI=1S/C13H4F12O/c14-6-3-1-5(2-4-6)8(26)7(15)9(16)10(17,18)11(19,20)12(21,22)13(23,24)25/h1-4H/b9-7+
InChIKey KEFZTBVDCHURBP-VQHVLOKHSA-N
Molecular Weight 404.155 g/mol
SMILES C(C(\C(=C\(C(c1ccc(cc1)F)=O)F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F
SPLASH splash10-001i-0090200000-e1e0aa8caa8ad5829130
Source of Spectrum J-58-6673-1
Wiley ID 1371011