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5-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptyl)-3-phenyl-1H-1,2,4-triazole
SpectraBase Compound ID In3uUxGdVAs
InChI InChI=1S/C15H6F15N3/c16-9(17,8-31-7(32-33-8)6-4-2-1-3-5-6)10(18,19)11(20,21)12(22,23)13(24,25)14(26,27)15(28,29)30/h1-5H,(H,31,32,33)
InChIKey PXAISCRTQIWSKQ-UHFFFAOYSA-N
Mol Weight 513.21 g/mol
Molecular Formula C15H6F15N3
Exact Mass 513.03222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BHpDWZp5m5A
Name 5-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptyl)-3-phenyl-1H-1,2,4-triazole
Alternate Name(s) 5-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecakis(fluoranyl)heptyl]-3-phenyl-1H-1,2,4-triazole
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Formula C15H6F15N3
InChI InChI=1S/C15H6F15N3/c16-9(17,8-31-7(32-33-8)6-4-2-1-3-5-6)10(18,19)11(20,21)12(22,23)13(24,25)14(26,27)15(28,29)30/h1-5H,(H,31,32,33)
InChIKey PXAISCRTQIWSKQ-UHFFFAOYSA-N
Molecular Weight 513.210 g/mol
SMILES [nH]1c(nc(n1)-c1ccccc1)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
SPLASH splash10-0006-1900030000-4ab4001d74e750a39448
Source of Spectrum F-68-607-2
Wiley ID 1571586