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1-[(E)-3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodec-1-enyl]-4-iodo-benzene
SpectraBase Compound ID 7beRsAKIrjc
InChI InChI=1S/C16H6F17I/c17-9(18,6-5-7-1-3-8(34)4-2-7)10(19,20)11(21,22)12(23,24)13(25,26)14(27,28)15(29,30)16(31,32)33/h1-6H/b6-5+
InChIKey XCANDLIUGAGJFS-AATRIKPKSA-N
Mol Weight 648.1 g/mol
Molecular Formula C16H6F17I
Exact Mass 647.924274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7AntJEajRNV
Name 1-[(E)-3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodec-1-enyl]-4-iodo-benzene
Alternate Name(s) 1-[(E)-3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecakis(fluoranyl)dec-1-enyl]-4-iodanyl-benzene
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Formula C16H6F17I
InChI InChI=1S/C16H6F17I/c17-9(18,6-5-7-1-3-8(34)4-2-7)10(19,20)11(21,22)12(23,24)13(25,26)14(27,28)15(29,30)16(31,32)33/h1-6H/b6-5+
InChIKey XCANDLIUGAGJFS-AATRIKPKSA-N
Molecular Weight 648.101 g/mol
SMILES C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C(C(C(\C=C\c1ccc(cc1)I)(F)F)(F)F)(F)F)(F)F
SPLASH splash10-0udi-0910000000-4a817c6242928a9a2a82
Source of Spectrum K1-2001-1127-1
Wiley ID 846769