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5,6-dimethyl-BbF
SpectraBase Compound ID 9eBNhJzpQGN
InChI InChI=1S/C22H16/c1-13-10-19-18-9-5-8-17-16-7-4-3-6-15(16)12-21(22(17)18)20(19)11-14(13)2/h3-12H,1-2H3
InChIKey NNPXJNHIPBFDOD-UHFFFAOYSA-N
Mol Weight 280.37 g/mol
Molecular Formula C22H16
Exact Mass 280.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GHOcoz6khet
Name 5,6-dimethyl-BbF
CAS Registry Number 95741-53-0
Comments Less than 3 mono-isotopic peaks
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Formula C22H16
InChI InChI=1S/C22H16/c1-13-10-19-18-9-5-8-17-16-7-4-3-6-15(16)12-21(22(17)18)20(19)11-14(13)2/h3-12H,1-2H3
InChIKey NNPXJNHIPBFDOD-UHFFFAOYSA-N
Molecular Weight 280.370 g/mol
SMILES c1-2c(-c3cccc4c3c2cc2c4cccc2)cc(c(c1)C)C
SPLASH splash10-00lr-0090000000-9e85877ea6d1a547d0d3
Source of Spectrum J-50-1953-12
Synonyms 5,6-Dimethylbenzo[e]acephenanthrylene
Wiley ID 1284564