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m-Tris(3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooctyl)methyl]benzyl bromide
SpectraBase Compound ID 68xCpeb8RRc
InChI InChI=1S/C32H18BrF39/c33-11-12-2-1-3-13(10-12)14(4-7-15(34,35)18(40,41)21(46,47)24(52,53)27(58,59)30(64,65)66,5-8-16(36,37)19(42,43)22(48,49)25(54,55)28(60,61)31(67,68)69)6-9-17(38,39)20(44,45)23(50,51)26(56,57)29(62,63)32(70,71)72/h1-3,10H,4-9,11H2
InChIKey BHHDRCHBXYQMLV-UHFFFAOYSA-N
Mol Weight 1223.3 g/mol
Molecular Formula C32H18BrF39
Exact Mass 1221.996912 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9myUfrEYwxH
Name m-Tris(3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooctyl)methyl]benzyl bromide
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Formula C32H18BrF39
InChI InChI=1S/C32H18BrF39/c33-11-12-2-1-3-13(10-12)14(4-7-15(34,35)18(40,41)21(46,47)24(52,53)27(58,59)30(64,65)66,5-8-16(36,37)19(42,43)22(48,49)25(54,55)28(60,61)31(67,68)69)6-9-17(38,39)20(44,45)23(50,51)26(56,57)29(62,63)32(70,71)72/h1-3,10H,4-9,11H2
InChIKey BHHDRCHBXYQMLV-UHFFFAOYSA-N
Molecular Weight 1223.338 g/mol
SMILES C(C(C(C(CCC(c1cc(CBr)ccc1)(CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F
SPLASH splash10-014l-4900000110-402651038dfffbb9d53e
Source of Spectrum KC-57-5569-3
Wiley ID 1624754