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18-Bromo-tricyclo[10.2.2.2*4,7*]octadeca-1(15),4(18),5,7(17),12(16),13-hexaene
SpectraBase Compound ID HN3SyNHYP5W
InChI InChI=1S/C18H19Br/c19-18-13-16-4-2-1-3-14-5-7-15(8-6-14)9-11-17(18)12-10-16/h5-8,10,12-13H,1-4,9,11H2
InChIKey YKHZZPQTVZEMFK-UHFFFAOYSA-N
Mol Weight 315.25 g/mol
Molecular Formula C18H19Br
Exact Mass 314.067014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID jWH9fVi57m
Name 18-Bromo-tricyclo[10.2.2.2*4,7*]octadeca-1(15),4(18),5,7(17),12(16),13-hexaene
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Formula C18H19Br
InChI InChI=1S/C18H19Br/c19-18-13-16-4-2-1-3-14-5-7-15(8-6-14)9-11-17(18)12-10-16/h5-8,10,12-13H,1-4,9,11H2
InChIKey YKHZZPQTVZEMFK-UHFFFAOYSA-N
Molecular Weight 315.254 g/mol
SMILES c1(c2CCc3ccc(CCCCc(c1)cc2)cc3)Br
SPLASH splash10-09ki-0439000000-7ec71dc4c8f0a89acdbc
Source of Spectrum U1-2009-246-23
Synonyms 7-Bromo[4.2]paracyclophane
Wiley ID 1662370