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4,5 : 8,9-Dibenzopentacyclo[8.4.0.0(2,7).0(3,12).0(6,11) ]-tetradeca-4,8,13-triene
SpectraBase Compound ID 6z9eZjPQS31
InChI InChI=1S/C22H18/c1-3-7-13-11(5-1)17-15-9-10-16-18-12-6-2-4-8-14(12)20(21(16)17)19(13)22(15)18/h1-10,15-22H/t15-,16-,17-,18-,19+,20+,21-,22+/m0/s1
InChIKey KXRAEUXWTMJFLP-YYSFWSAFSA-N
Mol Weight 282.39 g/mol
Molecular Formula C22H18
Exact Mass 282.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1fxULk00FMK
Name 4,5 : 8,9-Dibenzopentacyclo[8.4.0.0(2,7).0(3,12).0(6,11) ]-tetradeca-4,8,13-triene
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Formula C22H18
InChI InChI=1S/C22H18/c1-3-7-13-11(5-1)17-15-9-10-16-18-12-6-2-4-8-14(12)20(21(16)17)19(13)22(15)18/h1-10,15-22H/t15-,16-,17-,18-,19+,20+,21-,22+/m0/s1
InChIKey KXRAEUXWTMJFLP-YYSFWSAFSA-N
Molecular Weight 282.386 g/mol
SMILES [C@]12([C@@]3([C@]4([C@@](c5c2cccc5)([C@]2([C@]1([C@]([C@@]4(C=C2)[H])(c1ccccc31)[H])[H])[H])[H])[H])[H])[H]
SPLASH splash10-00lr-0390000000-25c1ef84b5ad751f3c94
Source of Spectrum K-126-2293-0
Synonyms Heptacyclo[12.8.0.0(2,11).0(3,16).0(4,9).0(10,15).0(17,22)]docosa-4,6,8,12,17,19,21-heptaene
Wiley ID 1286614