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1-Bromoazupyrene
SpectraBase Compound ID 3MMDuHZ8egi
InChI InChI=1S/C16H9Br/c17-14-9-12-5-1-3-10-7-8-11-4-2-6-13(14)16(12)15(10)11/h1-9H
InChIKey FNFPKYFIINPXES-UHFFFAOYSA-N
Mol Weight 281.15 g/mol
Molecular Formula C16H9Br
Exact Mass 279.988763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7U2PbIyu1ar
Name 1-Bromoazupyrene
Alternate Name(s) 1-bromodicyclopenta[ef,kl]heptalene
CAS Registry Number 109801-98-1
Comments Less than 3 mono-isotopic peaks
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Formula C16H9Br
InChI InChI=1S/C16H9Br/c17-14-9-12-5-1-3-10-7-8-11-4-2-6-13(14)16(12)15(10)11/h1-9H
InChIKey FNFPKYFIINPXES-UHFFFAOYSA-N
Molecular Weight 281.152 g/mol
SMILES c12c3cc(c2cccc2c1c(cc2)ccc3)Br
SPLASH splash10-0f89-0090000000-2491db7f72ae9dd0a71f
Source of Spectrum J-52-4393-4
Wiley ID 1283878