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3,6,8,10-TETRACYCLOHEXYLPYRENE
SpectraBase Compound ID 52Qw8LsHpH8
InChI InChI=1S/C40H52/c1-5-13-27(14-6-1)31-21-22-33-36(29-17-9-3-10-18-29)26-38-37(30-19-11-4-12-20-30)25-35(28-15-7-2-8-16-28)34-24-23-32(31)39(33)40(34)38/h21-25,27-30,36H,1-20,26H2
InChIKey JVFNRVSNFNTBED-UHFFFAOYSA-N
Mol Weight 532.9 g/mol
Molecular Formula C40H52
Exact Mass 532.406902 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EIBdLmByk5q
Name 3,6,8,10-TETRACYCLOHEXYLPYRENE
Compound Number 2AH(+)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H52
InChI InChI=1S/C40H52/c1-5-13-27(14-6-1)31-21-22-33-36(29-17-9-3-10-18-29)26-38-37(30-19-11-4-12-20-30)25-35(28-15-7-2-8-16-28)34-24-23-32(31)39(33)40(34)38/h21-25,27-30,36H,1-20,26H2
InChIKey JVFNRVSNFNTBED-UHFFFAOYSA-N
Literature Reference Author K.K.LAALI,P.E.HANSEN
Literature Reference Citation J.CHEM.SOC.PERKIN-2,2249(1994)
Literature Reference DOI 10.1039/p29940002249
Molecular Weight 532.853 g/mol
Solvent Unknown