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5-Bromo-tricyclo[9.2.2.2*4,7*]heptadeca-1(14),4(17),5,7(16),11(15),12-hexaene
SpectraBase Compound ID C0F8lciLE2y
InChI InChI=1S/C17H17Br/c18-17-12-15-3-1-2-13-4-6-14(7-5-13)8-10-16(17)11-9-15/h4-7,9,11-12H,1-3,8,10H2
InChIKey OICXZIZRELAPJF-UHFFFAOYSA-N
Mol Weight 301.23 g/mol
Molecular Formula C17H17Br
Exact Mass 300.051364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 24S4jeV8Bx7
Name 5-Bromo-tricyclo[9.2.2.2*4,7*]heptadeca-1(14),4(17),5,7(16),11(15),12-hexaene
Alternate Name(s) 6-Bromo[3.2]paracyclophane
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Formula C17H17Br
InChI InChI=1S/C17H17Br/c18-17-12-15-3-1-2-13-4-6-14(7-5-13)8-10-16(17)11-9-15/h4-7,9,11-12H,1-3,8,10H2
InChIKey OICXZIZRELAPJF-UHFFFAOYSA-N
Molecular Weight 301.227 g/mol
SMILES c1(c2ccc(c1)CCCc1ccc(CC2)cc1)Br
SPLASH splash10-0gb9-0903000000-302e948d4dc4c1072185
Source of Spectrum U1-2009-246-22
Wiley ID 1662371