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2,3:6,7:8,9:12,13-Tetrabenzo-trans,trans-[13]annulene
SpectraBase Compound ID FUYcyfOMhnQ
InChI InChI=1S/C29H22/c1-3-13-26-21-27-14-4-2-10-23(27)18-20-25-12-6-8-16-29(25)28-15-7-5-11-24(28)19-17-22(26)9-1/h1-20H,21H2/b19-17-,20-18-
InChIKey RZKGSWBVXRERJL-CLFAGFIQSA-N
Mol Weight 370.5 g/mol
Molecular Formula C29H22
Exact Mass 370.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AcXsCJIzj1o
Name 2,3:6,7:8,9:12,13-Tetrabenzo-trans,trans-[13]annulene
Alternate Name(s) 2,3:6,7:8,9:12,13-Tetrabenzo-cis,trans-[13]annulene 15H-Tetrabenzo[a,c,g,j]cyclotridecene
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Formula C29H22
InChI InChI=1S/C29H22/c1-3-13-26-21-27-14-4-2-10-23(27)18-20-25-12-6-8-16-29(25)28-15-7-5-11-24(28)19-17-22(26)9-1/h1-20H,21H2/b19-17-,20-18-
InChIKey RZKGSWBVXRERJL-CLFAGFIQSA-N
Molecular Weight 370.495 g/mol
SMILES c12-c3c(\C=C/c4c(cccc4)Cc4c(\C=C/c1cccc2)cccc4)cccc3
SPLASH splash10-0006-0901000000-ce526883998923a70844
Source of Spectrum SO-1977-410-3
Wiley ID 1536966