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3-(4-Chlorooctafluorobutyl)-4-amino-4'-chlorobiphenyl

View entire compound with spectra: 1 MS (GC)

3-(4-Chlorooctafluorobutyl)-4-amino-4'-chlorobiphenyl
SpectraBase Compound ID DLIuwCNhzmf
InChI InChI=1S/C16H9Cl2F8N/c17-10-4-1-8(2-5-10)9-3-6-12(27)11(7-9)13(19,20)14(21,22)15(23,24)16(18,25)26/h1-7H,27H2
InChIKey KAIFMYRCLKERRO-UHFFFAOYSA-N
Mol Weight 438.15 g/mol
Molecular Formula C16H9Cl2F8N
Exact Mass 436.99843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AG4rv9W29F6
Name 3-(4-Chlorooctafluorobutyl)-4-amino-4'-chlorobiphenyl
Alternate Name(s) 4'-chloro-3-(4-chloro-1,1,2,2,3,3,4,4-octafluorobutyl)[1,1'-biphenyl]-4-amine 4'-chloro-3-(4-chloro-1,1,2,2,3,3,4,4-octafluorobutyl)[1,1'-biphenyl]-4-ylamine
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Formula C16H9Cl2F8N
InChI InChI=1S/C16H9Cl2F8N/c17-10-4-1-8(2-5-10)9-3-6-12(27)11(7-9)13(19,20)14(21,22)15(23,24)16(18,25)26/h1-7H,27H2
InChIKey KAIFMYRCLKERRO-UHFFFAOYSA-N
Molecular Weight 438.148 g/mol
SMILES Nc1c(C(C(C(C(Cl)(F)F)(F)F)(F)F)(F)F)cc(-c2ccc(cc2)Cl)cc1
SPLASH splash10-0f79-0060900000-45fdbcfe172e1e6c070f
Source of Spectrum KC-0-2461-14
Wiley ID 779877