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ZZQQWABESMGMCA-UHFFFAOYSA-N
SpectraBase Compound ID BOl7OzWPYtm
InChI InChI=1S/C31H42NO2/c1-15(2)20-11-21(16(3)4)26-13-23(18(7)8)30-29-27(14-24(19(9)10)31(30)32(33)34)22(17(5)6)12-25(20)28(26)29/h11-19,24,33-34H,1-10H3/q+1
InChIKey ZZQQWABESMGMCA-UHFFFAOYSA-N
Mol Weight 458.7 g/mol
Molecular Formula C31H40NO2
Exact Mass 458.305905 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DqCXzuLWuIo
Name ZZQQWABESMGMCA-UHFFFAOYSA-N
Compound Number 2;PROTONATED_FORM_OF_2,4,6,8,10-PENTAISOPRO PYL-1-NITROPYRENE_(#1)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H40NO2
InChI InChI=1S/C31H42NO2/c1-15(2)20-11-21(16(3)4)26-13-23(18(7)8)30-29-27(14-24(19(9)10)31(30)32(33)34)22(17(5)6)12-25(20)28(26)29/h11-19,24,33-34H,1-10H3/q+1
InChIKey ZZQQWABESMGMCA-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 458.664 g/mol
Solvent CF3SO3H-SO2