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(rac)-4-Bromo[2.2]paracyclophane
SpectraBase Compound ID cRJLSZFfnb
InChI InChI=1S/C16H15Br/c17-16-11-14-6-5-12-1-3-13(4-2-12)7-9-15(16)10-8-14/h1-4,8,10-11H,5-7,9H2
InChIKey RJOYWTPJYZNRJD-UHFFFAOYSA-N
Mol Weight 287.2 g/mol
Molecular Formula C16H15Br
Exact Mass 286.035713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IZdkTCOrQWy
Name (R)-(+)-4-Bromo[2.2]paracyclophane
Alternate Name(s) 5-Bromotricyclo[8.2.2.2(4,7)]hexadeca-1(12),4,6,10,13,15-hexaene
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Formula C16H15Br
InChI InChI=1S/C16H15Br/c17-16-11-14-6-5-12-1-3-13(4-2-12)7-9-15(16)10-8-14/h1-4,8,10-11H,5-7,9H2
InChIKey RJOYWTPJYZNRJD-UHFFFAOYSA-N
Molecular Weight 287.200 g/mol
SMILES c1(c2CCc3ccc(CCc(c1)cc2)cc3)Br
SPLASH splash10-0udi-0910000000-c7adc7575ee8c53340a6
Source of Spectrum J-62-3747-3
Wiley ID 1289823