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6-Fluoro-5-{2'-[3'-(2"-Fluorophenyl)bicyclo[2.2.1]heptyl}-1,2,3,4,4a,8b-hexahydro-1,4-methanobiphenyleme
SpectraBase Compound ID 6ZxXYXY0OjI
InChI InChI=1S/C26H26F2/c27-19-4-2-1-3-17(19)21-13-5-8-16(11-13)24(21)26-20(28)10-9-18-22-14-6-7-15(12-14)23(22)25(18)26/h1-4,9-10,13-16,21-24H,5-8,11-12H2/t13-,14+,15-,16+,21+,22+,23+,24-/m1/s1
InChIKey CESMRSZBNJCFIW-UHFFFAOYSA-N
Mol Weight 376.49 g/mol
Molecular Formula C26H26F2
Exact Mass 376.200257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IdQQT07a1No
Name 6-Fluoro-5-{2'-[3'-(2"-Fluorophenyl)bicyclo[2.2.1]heptyl}-1,2,3,4,4a,8b-hexahydro-1,4-methanobiphenyleme
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Formula C26H26F2
InChI InChI=1S/C26H26F2/c27-19-4-2-1-3-17(19)21-13-5-8-16(11-13)24(21)26-20(28)10-9-18-22-14-6-7-15(12-14)23(22)25(18)26/h1-4,9-10,13-16,21-24H,5-8,11-12H2/t13-,14+,15-,16+,21+,22+,23+,24-/m1/s1
InChIKey CESMRSZBNJCFIW-UHFFFAOYSA-N
Molecular Weight 376.491 g/mol
SMILES c12[C@]3([C@]4(C[C@@]([C@]3(c2ccc(c1[C@]1([C@@]([C@]2(C[C@@]1(CC2)[H])[H])(c1c(F)cccc1)[H])[H])F)[H])(CC4)[H])[H])[H]
SPLASH splash10-0a4r-0902000000-4cb61126889e6b7be5e1
Source of Spectrum C5-2003-2677-16
Wiley ID 1616240