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Benzene, 2-[[2,2,3,3,4,4,4-heptafluoro-1,1-bis(trifluoromethyl)butyl]thio]-1,3,5-trimethyl-
SpectraBase Compound ID Hi38YO01rSX
InChI InChI=1S/C15H11F13S/c1-6-4-7(2)9(8(3)5-6)29-10(13(20,21)22,14(23,24)25)11(16,17)12(18,19)15(26,27)28/h4-5H,1-3H3
InChIKey PGQDIALQJRWGOY-UHFFFAOYSA-N
Mol Weight 470.29 g/mol
Molecular Formula C15H11F13S
Exact Mass 470.037388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HMvtudLuTUf
Name Benzene, 2-[[2,2,3,3,4,4,4-heptafluoro-1,1-bis(trifluoromethyl)butyl]thio]-1,3,5-trimethyl-
CAS Registry Number 115166-60-4
Comments Less than 3 mono-isotopic peaks
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Formula C15H11F13S
InChI InChI=1S/C15H11F13S/c1-6-4-7(2)9(8(3)5-6)29-10(13(20,21)22,14(23,24)25)11(16,17)12(18,19)15(26,27)28/h4-5H,1-3H3
InChIKey PGQDIALQJRWGOY-UHFFFAOYSA-N
Molecular Weight 470.292 g/mol
SMILES C(C(Sc1c(cc(cc1C)C)C)(C(F)(F)F)C(F)(F)F)(C(C(F)(F)F)(F)F)(F)F
SPLASH splash10-0udi-0900100000-dc85f304f80fff20866f
Source of Spectrum AJ-60-4472-3
Synonyms 2,2,3,3,4,4,4-heptafluoro-1,1-bis(trifluoromethyl)butyl mesityl sulfide 2-{[2,2,3,3,4,4,4-heptafluoro-1,1-bis(trifluoromethyl)butyl]sulfanyl}-1,3,5-trimethylbenzene 4-(2,4,6-Trimethylphenylthio)-4-trifluoromethyl-perfluoropentane
Wiley ID 1392706