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Benzene, [[2,2,3,3,4,4,4-heptafluoro-1,1-bis(trifluoromethyl)butyl]thio]pentamethyl-
SpectraBase Compound ID Fi1at42ihaV
InChI InChI=1S/C17H15F13S/c1-6-7(2)9(4)11(10(5)8(6)3)31-12(15(22,23)24,16(25,26)27)13(18,19)14(20,21)17(28,29)30/h1-5H3
InChIKey BVFQBNMTSCEJGB-UHFFFAOYSA-N
Mol Weight 498.35 g/mol
Molecular Formula C17H15F13S
Exact Mass 498.068688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IkkWy9N85pQ
Name Benzene, [[2,2,3,3,4,4,4-heptafluoro-1,1-bis(trifluoromethyl)butyl]thio]pentamethyl-
CAS Registry Number 115166-62-6
Comments Less than 3 mono-isotopic peaks
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Formula C17H15F13S
InChI InChI=1S/C17H15F13S/c1-6-7(2)9(4)11(10(5)8(6)3)31-12(15(22,23)24,16(25,26)27)13(18,19)14(20,21)17(28,29)30/h1-5H3
InChIKey BVFQBNMTSCEJGB-UHFFFAOYSA-N
Molecular Weight 498.346 g/mol
SMILES C(C(Sc1c(c(C)c(c(c1C)C)C)C)(C(F)(F)F)C(F)(F)F)(C(C(F)(F)F)(F)F)(F)F
SPLASH splash10-004i-0900100000-70d4545b8119d0165c27
Source of Spectrum AJ-60-4472-3
Synonyms 1-{[2,2,3,3,4,4,4-heptafluoro-1,1-bis(trifluoromethyl)butyl]sulfanyl}-2,3,4,5,6-pentamethylbenzene 2,2,3,3,4,4,4-heptafluoro-1,1-bis(trifluoromethyl)butyl 2,3,4,5,6-pentamethylphenyl sulfide 4-(2,3,4,5,6-Pentamethylphenylthio)-4-trifluoromethyl-perfluoropentane
Wiley ID 1398475