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PROTONATED_CYCLISED_FORM_OF_2,4,6,8,10-PENTAISOPROPYL-1-NITROPYRENE
SpectraBase Compound ID 9kOQC1V8XCL
InChI InChI=1S/C31H39NO/c1-15(2)19-11-20(16(3)4)24-13-22(18(7)8)29-28-25(14-26-30(29)32-33-31(26,9)10)21(17(5)6)12-23(19)27(24)28/h11-18,26H,1-10H3
InChIKey UYVHHCZNBDYZBP-UHFFFAOYSA-N
Mol Weight 441.7 g/mol
Molecular Formula C31H39NO
Exact Mass 441.303165 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3E3LlrNuMec
Name PROTONATED_CYCLISED_FORM_OF_2,4,6,8,10-PENTAISOPROPYL-1-NITROPYRENE
Compound Number 6;1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H39NO
InChI InChI=1S/C31H39NO/c1-15(2)19-11-20(16(3)4)24-13-22(18(7)8)29-28-25(14-26-30(29)32-33-31(26,9)10)21(17(5)6)12-23(19)27(24)28/h11-18,26H,1-10H3
InChIKey UYVHHCZNBDYZBP-UHFFFAOYSA-N
Literature Reference Author K.K.LAALI,S.BOLVIG,P.E.HANSEN
Literature Reference Citation J.CHEM.SOC.PERKIN-2,537(1995)
Literature Reference DOI 10.1039/p29950000537
Molecular Weight 441.657 g/mol
Solvent CF3SO3H-SO2