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1,1',8,8'-Tetrachloro-[9,9'-bianthracene]-1',1''(9H,9'H)-dione
SpectraBase Compound ID KwYNgkfILam
InChI InChI=1S/C28H14Cl4O2/c29-17-9-1-5-13-21(17)25(22-14(27(13)33)6-2-10-18(22)30)26-23-15(7-3-11-19(23)31)28(34)16-8-4-12-20(32)24(16)26/h1-12,25-26H
InChIKey VPOUJZSSBSVPAJ-UHFFFAOYSA-N
Mol Weight 524.2 g/mol
Molecular Formula C28H14Cl4O2
Exact Mass 521.97479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BUX9avTBuRh
Name 1,1',8,8'-Tetrachloro-[9,9'-bianthracene]-1',1''(9H,9'H)-dione
Alternate Name(s) 4,5-dichloro-10-(1,8-dichloro-10-oxo-9H-anthracen-9-yl)-10H-anthracen-9-one 10-[1,8-bis(chloranyl)-10-oxidanylidene-9H-anthracen-9-yl]-4,5-bis(chloranyl)-10H-anthracen-9-one
Comments Less than 3 mono-isotopic peaks
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Formula C28H14Cl4O2
InChI InChI=1S/C28H14Cl4O2/c29-17-9-1-5-13-21(17)25(22-14(27(13)33)6-2-10-18(22)30)26-23-15(7-3-11-19(23)31)28(34)16-8-4-12-20(32)24(16)26/h1-12,25-26H
InChIKey VPOUJZSSBSVPAJ-UHFFFAOYSA-N
Molecular Weight 524.230 g/mol
SMILES C1(C2c3c(C(=O)c4c2c(Cl)ccc4)cccc3Cl)c2c(C(=O)c3c1c(Cl)ccc3)cccc2Cl
SPLASH splash10-004i-0090000000-a9410209bb079efcb230
Source of Spectrum F2-45-5281-4
Wiley ID 1704049