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5,12-Dichlororubicene
SpectraBase Compound ID CyWtUqQPPaJ
InChI InChI=1S/C26H12Cl2/c27-13-7-9-17-21(11-13)15-3-1-5-19-23(15)26(17)20-6-2-4-16-22-12-14(28)8-10-18(22)25(19)24(16)20/h1-12H
InChIKey DGBOIBGREIFTSY-UHFFFAOYSA-N
Mol Weight 395.29 g/mol
Molecular Formula C26H12Cl2
Exact Mass 394.031606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FeyeLZHNZ2l
Name 5,12-Dichlororubicene
Comments Less than 3 mono-isotopic peaks
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Formula C26H12Cl2
InChI InChI=1S/C26H12Cl2/c27-13-7-9-17-21(11-13)15-3-1-5-19-23(15)26(17)20-6-2-4-16-22-12-14(28)8-10-18(22)25(19)24(16)20/h1-12H
InChIKey DGBOIBGREIFTSY-UHFFFAOYSA-N
Molecular Weight 395.288 g/mol
SMILES c1-2c3c(cccc3c-3c4c1cccc4-c1cc(Cl)ccc31)-c1c2ccc(Cl)c1
SPLASH splash10-0005-0009000000-575eba4a083e6e8b4f3f
Source of Spectrum U1-1998-2772-1
Wiley ID 752079