Characterization of humic acids extracted from a lignite and interpretation for the mass spectra

Humic acids obtained from a Chinese lignite via alkali treatment were analyzed using Fourier transform infrared spectroscopy and Orbitrap mass spectrometry coupled with an electrospray ion source (ESI-Orbitrap-MS). Raw coal and the corresponding residue were characterized via scanning electron micro...

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Veröffentlicht in:RSC advances 2017-01, Vol.7 (33), p.2677-2684
Hauptverfasser: Wang, Chu-Fan, Fan, Xing, Zhang, Fan, Wang, Shou-Ze, Zhao, Yun-Peng, Zhao, Xiao-Yan, Zhao, Wei, Zhu, Teng-Gao, Lu, Jin-Li, Wei, Xian-Yong
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container_issue 33
container_start_page 2677
container_title RSC advances
container_volume 7
creator Wang, Chu-Fan
Fan, Xing
Zhang, Fan
Wang, Shou-Ze
Zhao, Yun-Peng
Zhao, Xiao-Yan
Zhao, Wei
Zhu, Teng-Gao
Lu, Jin-Li
Wei, Xian-Yong
description Humic acids obtained from a Chinese lignite via alkali treatment were analyzed using Fourier transform infrared spectroscopy and Orbitrap mass spectrometry coupled with an electrospray ion source (ESI-Orbitrap-MS). Raw coal and the corresponding residue were characterized via scanning electron microscopy and energy dispersive spectrometry. Over 4700 heteroatom-containing compounds with wide distributions of molecular mass and unsaturation degree were detected via the ESI-Orbitrap-MS, and around 60 percent of the detected species were found to be oxygen-containing compounds. In addition, van Krevelen diagram and double-bond equivalent (DBE) plot were introduced to provide more structural details of the compounds. For the species only containing C, H, and O (HA CHO ), condensed aromatic compounds with a DBE value over 20 only contained 1 or 2 oxygen atoms. Carboxyl- and hydroxyl-containing aliphatic compounds (CHCACs) were predominant in HA CHO with 5 or 6 oxygen atoms. Both the CHCACs and aromatic carboxylic acids or phenols were grouped into clusters in the van Krevelen diagram to be recognized. The introduction of a nitrogen atom to the HA CHO species was based on the structures of the HA CHO species, which is also indicated by the van Krevelen diagram. Humic acids obtained from a Chinese lignite via alkali treatment were analyzed using Fourier transform infrared spectroscopy and Orbitrap mass spectrometry coupled with an electrospray ion source (ESI-Orbitrap-MS).
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Raw coal and the corresponding residue were characterized via scanning electron microscopy and energy dispersive spectrometry. Over 4700 heteroatom-containing compounds with wide distributions of molecular mass and unsaturation degree were detected via the ESI-Orbitrap-MS, and around 60 percent of the detected species were found to be oxygen-containing compounds. In addition, van Krevelen diagram and double-bond equivalent (DBE) plot were introduced to provide more structural details of the compounds. For the species only containing C, H, and O (HA CHO ), condensed aromatic compounds with a DBE value over 20 only contained 1 or 2 oxygen atoms. Carboxyl- and hydroxyl-containing aliphatic compounds (CHCACs) were predominant in HA CHO with 5 or 6 oxygen atoms. Both the CHCACs and aromatic carboxylic acids or phenols were grouped into clusters in the van Krevelen diagram to be recognized. The introduction of a nitrogen atom to the HA CHO species was based on the structures of the HA CHO species, which is also indicated by the van Krevelen diagram. 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Raw coal and the corresponding residue were characterized via scanning electron microscopy and energy dispersive spectrometry. Over 4700 heteroatom-containing compounds with wide distributions of molecular mass and unsaturation degree were detected via the ESI-Orbitrap-MS, and around 60 percent of the detected species were found to be oxygen-containing compounds. In addition, van Krevelen diagram and double-bond equivalent (DBE) plot were introduced to provide more structural details of the compounds. For the species only containing C, H, and O (HA CHO ), condensed aromatic compounds with a DBE value over 20 only contained 1 or 2 oxygen atoms. Carboxyl- and hydroxyl-containing aliphatic compounds (CHCACs) were predominant in HA CHO with 5 or 6 oxygen atoms. Both the CHCACs and aromatic carboxylic acids or phenols were grouped into clusters in the van Krevelen diagram to be recognized. 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Raw coal and the corresponding residue were characterized via scanning electron microscopy and energy dispersive spectrometry. Over 4700 heteroatom-containing compounds with wide distributions of molecular mass and unsaturation degree were detected via the ESI-Orbitrap-MS, and around 60 percent of the detected species were found to be oxygen-containing compounds. In addition, van Krevelen diagram and double-bond equivalent (DBE) plot were introduced to provide more structural details of the compounds. For the species only containing C, H, and O (HA CHO ), condensed aromatic compounds with a DBE value over 20 only contained 1 or 2 oxygen atoms. Carboxyl- and hydroxyl-containing aliphatic compounds (CHCACs) were predominant in HA CHO with 5 or 6 oxygen atoms. Both the CHCACs and aromatic carboxylic acids or phenols were grouped into clusters in the van Krevelen diagram to be recognized. 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subjects Aliphatic compounds
Aromatic compounds
Carboxylic acids
Fourier transforms
Humic acids
Infrared analysis
Ion sources
Ions
Lignite
Mass spectra
Mass spectrometry
Oxygen atoms
Phenols
Scanning electron microscopy
Scientific imaging
title Characterization of humic acids extracted from a lignite and interpretation for the mass spectra
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