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1,3,6,8-TETRACYClOPENTYLPYRENE-DICATION
SpectraBase Compound ID IcCjoHlpitN
InChI InChI=1S/C36H44/c1-2-10-23(9-1)31-21-32(24-11-3-4-12-24)28-19-20-30-34(26-15-7-8-16-26)22-33(25-13-5-6-14-25)29-18-17-27(31)35(28)36(29)30/h17-26,31,34H,1-16H2
InChIKey XUIBYOGSKXMUBA-UHFFFAOYSA-N
Mol Weight 476.7 g/mol
Molecular Formula C36H44
Exact Mass 476.344301 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DezUPlBedYi
Name 1,3,6,8-TETRACYClOPENTYLPYRENE-DICATION
CAS Registry Number 149306-47-8
Compound Number 4(+ 2)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H44
InChI InChI=1S/C36H44/c1-2-10-23(9-1)31-21-32(24-11-3-4-12-24)28-19-20-30-34(26-15-7-8-16-26)22-33(25-13-5-6-14-25)29-18-17-27(31)35(28)36(29)30/h17-26,31,34H,1-16H2
InChIKey XUIBYOGSKXMUBA-UHFFFAOYSA-N
Literature Reference Author K.K.LAALI,P.E.HANSEN,E.GELERINTER,J.J.HOUSER
Literature Reference Citation J.ORG.CHEM.,58,4088(1993)
Literature Reference DOI 10.1021/jo00067a049
Molecular Weight 476.745 g/mol
Solvent ACETONE-D6
Source File Reference UWSP10040