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4,5,11,11-Tetrabromo-4,5,8,9,10,11-hexahydrocyclohepta[a]phenanlene-6,12-dione
SpectraBase Compound ID A8091jaWpkg
InChI InChI=1S/C18H12Br4O2/c19-14-10-5-1-4-9-12-8(3-2-6-18(21,22)17(12)24)7-11(13(9)10)16(23)15(14)20/h1,4-5,7,14-15H,2-3,6H2
InChIKey RMWIRTXSIJVFQA-UHFFFAOYSA-N
Mol Weight 579.91 g/mol
Molecular Formula C18H12Br4O2
Exact Mass 575.757082 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AiVPt3HOztN
Name 4,5,11,11-Tetrabromo-4,5,8,9,10,11-hexahydrocyclohepta[a]phenanlene-6,12-dione
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Formula C18H12Br4O2
InChI InChI=1S/C18H12Br4O2/c19-14-10-5-1-4-9-12-8(3-2-6-18(21,22)17(12)24)7-11(13(9)10)16(23)15(14)20/h1,4-5,7,14-15H,2-3,6H2
InChIKey RMWIRTXSIJVFQA-UHFFFAOYSA-N
Molecular Weight 579.908 g/mol
SMILES c12c3c(cccc3c3c(c1)CCCC(C3=O)(Br)Br)C(C(C2=O)Br)Br
SPLASH splash10-001i-0090300000-12fe6b4461f0927bec39
Source of Spectrum AJ-64-978-10
Synonyms 4,5,11,11-tetrabromo-4,5,8,9,10,11-hexahydrocyclohepta[a]phenalene-6,12-dione
Wiley ID 770947