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1,6-bis(Bicyclo[4.4.1]undeca-1',3',5',7',9'-pentaene-2'-yl)hexa-1,3,5-triene
SpectraBase Compound ID 9nV7KRBLDVJ
InChI InChI=1S/C28H24/c1(3-15-25-19-9-13-23-11-5-7-17-27(25)21-23)2-4-16-26-20-10-14-24-12-6-8-18-28(26)22-24/h1-20H,21-22H2/b2-1+,15-3+,16-4+
InChIKey MIUSNYGNUKZNTO-DXRSETDZSA-N
Mol Weight 360.5 g/mol
Molecular Formula C28H24
Exact Mass 360.187801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Qmq2vtjHqd
Name 1,6-bis(Bicyclo[4.4.1]undeca-1',3',5',7',9'-pentaene-2'-yl)hexa-1,3,5-triene
Comments Less than 3 mono-isotopic peaks
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Formula C28H24
InChI InChI=1S/C28H24/c1(3-15-25-19-9-13-23-11-5-7-17-27(25)21-23)2-4-16-26-20-10-14-24-12-6-8-18-28(26)22-24/h1-20H,21-22H2/b2-1+,15-3+,16-4+
InChIKey MIUSNYGNUKZNTO-DXRSETDZSA-N
Molecular Weight 360.500 g/mol
SMILES C12=C(C=CC=C(C2)C=CC=C1)\C=C\C=C\C=C\C1=C2CC(C=CC=C2)=CC=C1
SPLASH splash10-03xr-0609000000-3d667bb34b97693684b4
Source of Spectrum G-56-2264-3
Synonyms 2-[(1E,3E,5E)-6-bicyclo[4.4.1]undeca-1,3,5,7,9-pentaen-2-yl-1,3,5-hexatrienyl]bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
Wiley ID 748444