Abstract

High-resolution matrix-assisted laser desorption/ionization time-of-flight mass spectrometry (MALDI-TOF MS) combined with other analytical techniques and aromatic structure analysis were employed to characterize and identify large polycyclic aromatic hydrocarbons (PAHs) in coal tar pitch and its hexane-soluble fraction. Nonsubstituted aromatics in high abundance up to 850 Da can be extracted successfully with defined molecular formula from MALDI spectra, and mapped systematically into a 50/24 matrix, indicating a structural growth pattern by cooperative ortho-condensation and bay-condensation. The matrix provided a quantitative summary, with their quantity and chemical structures defined essentially by MS intensity and molecular formula of PAHs isomers, respectively. It also revealed a trend that the PAHs grown alternatingly at ortho and bay positions exhibit much higher concentrations than those by ortho- or bay-condensations alone, even though their relative abundance by MS intensity may drop as aromati...

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