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trans-1,2-Di(1-pyrenyl)cyclobutane
SpectraBase Compound ID FvOCtHJIqEF
InChI InChI=1S/C36H24/c1-3-21-7-9-25-11-15-29(31-17-13-23(5-1)33(21)35(25)31)27-19-20-28(27)30-16-12-26-10-8-22-4-2-6-24-14-18-32(30)36(26)34(22)24/h1-18,27-28H,19-20H2/t27-,28-/m1/s1
InChIKey BGUSKZQBNGUWHA-VSGBNLITSA-N
Mol Weight 456.6 g/mol
Molecular Formula C36H24
Exact Mass 456.187801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K8jiKeLD1oW
Name trans-1,2-Di(1-pyrenyl)cyclobutane
Alternate Name(s) 1-[(1R,2R)-2-(1-pyrenyl)cyclobutyl]pyrene
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Formula C36H24
InChI InChI=1S/C36H24/c1-3-21-7-9-25-11-15-29(31-17-13-23(5-1)33(21)35(25)31)27-19-20-28(27)30-16-12-26-10-8-22-4-2-6-24-14-18-32(30)36(26)34(22)24/h1-18,27-28H,19-20H2/t27-,28-/m1/s1
InChIKey BGUSKZQBNGUWHA-VSGBNLITSA-N
Molecular Weight 456.588 g/mol
SMILES c12c3c4c(cccc4cc2)ccc3ccc1[C@]1([C@](c2c3c4c5c(cccc5cc3)ccc4cc2)(CC1)[H])[H]
SPLASH splash10-004i-0090100000-d5138c8f838c713613db
Source of Spectrum AJ-64-3403-2
Wiley ID 1389574