• 承担主要项目

重点(联合)基金项目:

1. 渣油临甲烷碱催化技术基础理论研究(U23B20169, 2024-2027)

2. 海洋原油分子组成表征及分离过程模型构建(U19B2002, 2020-2023)

3. 基于ESI FT-ICR MS的重质油分子组成研究(21236009, 2013-2017)


面上基金项目:

1. 石油含硫化合物分子组学地球化学分析方法与应用(41773038,2018-2021)

2. 重质油中镍、钒存在形态及其对加工性能的影响(21376262, 2014-2017)


国家重点研发计划项目(课题):

1. 原油分子水平识别及其催化转化路径研究(2021YFA1501201,2022-2026.12)

2. 稠油分子组成及相互作用及致黏机理 (2018YFA0702401,2019.9-2024.8)

3. 中国典型海区碳指纹与碳足迹标识体系理论和应用研究(2020YFA0607602,2020.11-2025.10)

4. 海洋惰性有机碳存在形态与形成机制的化学基础(2018YFA0605803,2018.5-2023.4)


企业重大项目:

1. 煤液化重质产物梯级分离关键技术研究(国家能源,2023.12-2025.12)

2. 原油、重质馏分分子表征及数据库开发 (中石油,2023.3-2024.6)

3. 劣质重油分子层次认识和加工转化规律研究及数据库软件开发(中石油,2014.6-2018.9)

4. 基于分子管理的炼化新技术开发技术方案研究(中石油,2014.8-2015.8)

5. 重油分子组成及加工过程分子转化模型研究(中石油,2011. 7- 2014.12)

6. 劣质重油资源调研、性质表征及加工方案研究(中石油,2008.4-2011.12)


  • 主要科研成果(详见专题)

1. 石油分子组成表征方法

2. 重质油化学组成与加工过程分子转化规律

3. 石油含硫化合物

4. 煤液化产物分子组成分析方法与应用

5. 溶解性有机质分子组成分析方法与应用

6. 大气气溶胶化学

7. 分子组成数据库


  • 专利

1. 一种硝酸银硅胶与石油中硫醇类化合物的分离方法(202410077522.5)

2. 一种分离石油油品中含硫化合物的方法(202311820261.3)

3. 有机物中羧酸化合物衍生和分离方法以及分析方法(202410403354.4)

4. 一种石油油品分子组成确定方法(202211541473.3)

5. 一种分离石油油品中噻吩类化合物的方法及其应用(202211536216.0)

6. 一种分析水溶有机质分子碳骨架结构特征的方法(202111271304.8)

7. 石油组分中咔唑类氮化物的分离方法和应用(202110053582.X)

8. 一种石油油品中芳香烃类化合物的磺化方法和分析方法(202111319983.1)

9. 污水中磺酸盐类化合物的分离方法和溶解性有机质分子组成分析方法(202111491918.7)

10. 一种分离石油油品中硫醚化合物的方法(202010222810.7)

11. 一种石油组分中含硫化合物烷基衍生化和分离的方法(202010263556.5)

12. 一种分析石油油品中芳香烃类化合物分子组成的方法(202010223193.2)

13. 一种分析石油中硫醇化合物分子组成的方法(201510630019.9)

14. 一种分离与分析石油组分中非碱性氮化合物的方法(201510151572.4)

15. 一种多环芳烃含量的分析方法及其应用(201510887902.6)

16. 一种分离石油组分中含硫化合物的方法(201410038248.7)


  • 科技奖励

1. 石油炼化分子管理基础,中国化工学会科学技术奖,基础研究奖,一等奖,2022-11-28 

2. 重油非烃类大分子结构解析及反应行为研究,中国化工学会科学技术奖,基础研究奖,一等奖,2020-12-28

3. 高酸值油的实验方法与成因成藏模式,中国石油和化学工业联合会科学技术奖,科技进步奖,一等奖,2015-12-28 

4. 油藏微生物资源研究与应用, 中国石油和化学工业联合会科学技术奖,科技进步奖,二等奖,2012-01-01

5. 地质体中分子标志物的新发现及其应用,教育部高等学校科学研究优秀成果奖,自然科学奖,二等奖,2018-12-31

6. 地下水有机污染风险识别和修复技术开发与应用,自然资源科学技术奖, 科技进步奖二等奖,2024-10-22 

7. 中国西部海相油气成藏理论与示踪技术及工业应用,国土资源科学技术奖,科学技术奖,二等奖,2021-10-15

8. 古生代复杂碳酸盐岩油气藏油气成因与成藏富集规律及工业应用,北京市科学技术奖,科技进步奖,一等奖,2021-09-25


  • 专著/专刊

1. 石油分子组成分析方法,石油工业出版社,2025

2. 石油炼化分子管理基础,中国科学出版社,2019

3. Structure and Modeling of Complex Petroleum Mixtures. (Structure and Bonding 系列 Vol. 168).  Springer,  2016.

4. 重质油国家重点实验室专刊: 重质油化学,中国科学-化学 2018, 48(4)

5. 专刊:Chemistr of Heavy Petroleum Fractions and Its Impacts on Rfining Processes, Science China Chemistry, 2013, 56(7)


  • 学术论文

检索日期:2024年12月30 日

数据库:Elserver Scopus 

检索 词:AU-ID ( "Shi, Quan" 35280644500 ) AND PUBYEAR > 2008 AND PUBYEAR < 2026 AND ( LIMIT-TO ( DOCTYPE , "ar" ) OR LIMIT-TO ( DOCTYPE , "re" ) )

结果:Article (358) + Review (7) = 365 篇

2024年 [1-38]

2023 [39-91]

2022 [92-136]

2021 [137-180]

2020 [181-220]

2019 [221-255]

2018 [256-279]

2017 [280-290]

2016 [291-305]

2015 [306-314]

2014 [315-322]

2013 [323-337]

2012 [338-346]

2011 [347-354]

2010 [355-362]

2009 [363, 364]

 

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[2]         Zhao QH, Wu JX, Zhou TH, Zhao SQ, Shi Q. Impact of molecular composition on viscosity of heavy oil: Machine learning based on semi-quantitative analysis results from high-resolution mass spectrometry. Petrol Sci 2024 DOI: 10.1016/j.petsci.2024.03.026.

[3]         Zhao H, Zhang Z, Nair S, Li H, He C, Shi Q, et al. Overlooked Vital Role of Persistent Algae-Bacteria Interaction in Ocean Recalcitrant Carbon Sequestration and Its Response to Ocean Warming. Global Change Biol 2024;30(11) DOI: 10.1111/gcb.17570.

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[5]         Zhang W, Wu J, Li S, Zhang Y, Zhao S, Shi Q. Classification Method of Heavy Oil Based on Chemical Composition and Bulk Properties. Energies 2024;17(15) DOI: 10.3390/en17153733.

[6]         Zhang B, Xu C, Shi Q, Li Y, Liu Z, Wu J. Wettability of Different Mineral Surfaces in Supercritical CO2 Extraction: Interpretations from the Molecular Composition of Crude Oil. Energy Fuels 2024;38(10):8589-97 DOI: 10.1021/acs.energyfuels.4c00808.

[7]         Zeng X, He W, Shi Q, Guo H, He C, Shi Q, et al. Seasonal sensitivity of groundwater dissolved organic matter in recognition of chronic kidney disease of unknown etiology: Optical and molecular perspectives. Sci Total Environ 2024;919 DOI: 10.1016/j.scitotenv.2024.170813.

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[16]       Wang J, Xie L, Peng Y, Yin T, Jiang H, Wang Z, et al. Molecular composition of direct coal liquefaction products obtained from the Shenhua industrial plant. Fuel 2024;357 DOI: 10.1016/j.fuel.2023.129735.

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[18]       Pan Q, He C, Shi Q. Graph-Based Method for Calibration of High-Resolution Mass Spectra of Natural Organic Matter. Anal Chem 2024;96(9):3739-43 DOI: 10.1021/acs.analchem.3c05423.

[19]       Li YG, He C, Chen CM, Liu F, Shi Q. Molecular investigation into the transformation of recalcitrant dissolved organic sulfur in refinery sour water during stripping process. Petrol Sci 2024;21(3):2112-9 DOI: 10.1016/j.petsci.2024.01.005.

[20]       Li Y, Zhang Y, Liu M, Yang R, Liang Y, Shi Q. Reactivity and Molecular Transformation of Dissolved Organic Matter during the Treatment of Coal Gasification Wastewater. ACS EST 2024;4(11):4908-16 DOI: 10.1021/acsestwater.4c00538.

[21]       Li Y, He C, Zhang Y, Shi Q. Online LC-Orbitrap MS method for the rapid molecular characterization of dissolved organic matter. Rapid Commun Mass Spectrom 2024;38(20) DOI: 10.1002/rcm.9885.

[22]       Li S, Wu J, Wang Y, Zhang X, Zhang W, Zhang Y, et al. Isolation and characterization of thiols in petroleum using Ag+-silica solid phase extraction followed by gas chromatography-mass spectrometry and high-resolution mass spectrometry. Fuel 2024;363 DOI: 10.1016/j.fuel.2024.130946.

[23]       Li S, Wu J, Chen J, Li Y, Hu M, Huang S, et al. Semiquantitative Molecular Characterization of Crude Oil. Energy Fuels 2024;38(5):3769-83 DOI: 10.1021/acs.energyfuels.3c05086.

[24]       Li S, Hu H, Wu J, Kong F, Wang J, Shi Q. Rapid On-Column Esterification and Separation of Carboxylic Acids in Petroleum Fractions. Energy Fuels 2024;38(12):10737-43 DOI: 10.1021/acs.energyfuels.4c01119.

[25]       Li P, Liang W, Zhou Y, Yi Y, He C, Shi Q, et al. Hypoxia diversifies molecular composition of dissolved organic matter and enhances preservation of terrestrial organic carbon in the Yangtze River Estuary. Sci Total Environ 2024;906 DOI: 10.1016/j.scitotenv.2023.167661.

[26]       Li L, Zhang N, Zhang Y, Zhang Y, Shi Q, Sun Y, et al. Selective utilization of organic carbon molecules promotes arsenic methylation by increasing methyltransferase activity in arsM-harboring microbes of paddy soils. Soil Biol Biochem 2024;190 DOI: 10.1016/j.soilbio.2023.109305.

[27]       Kuoshiken U, Tileuberdi Y, Shi Q, Ongarbayev Y, Li S, Zhanbekov K, et al. Electrospray Ionization FT-ICR MS Analysis of Polar Compounds in Natural Bitumen of Munaily-Mola Oil Sands and Its Asphaltenes. ES Mater Manuf 2024;25 DOI: 10.30919/esmm1240.

[28]       Jiang Z, He C, Gao F, Shi Q, Chen Y, Yu H, et al. Molecular characteristics of organic matter derived from sulfonated biochar. Environ Sci Process Impacts 2024;26(9):1641-50 DOI: 10.1039/d4em00233d.

[29]       Huang C, Zhang Y, Li S, Shi Q, Zhao S, Zhang L. Recovering Valuable Hydrocarbon Molecules from Used Lubricating Oils via Supercritical CO2 Extraction. Energy Fuels 2024;38(1):160-70 DOI: 10.1021/acs.energyfuels.3c03814.

[30]       Hu H, Li S, Wang Y, Yang R, Wu J, Zhang W, et al. Molecular characterization of petroleum acids from diverse geological origins via n-Butylsilane reduction. Fuel 2024;374 DOI: 10.1016/j.fuel.2024.132429.

[31]       Hu H, He C, Zhu D, Zhang W, Zhuo X, Li Y, et al. Revealing the backbone structures of land-based fulvic acids derived from river and soil through n-butylsilane reduction. Anal Bioanal Chem 2024;416(29):6919-29 DOI: 10.1007/s00216-024-05589-y.

[32]       He C, Che H, Bao Z, Liu Y, Li Q, Hu M, et al. Evolution of nucleophilic high molecular-weight organic compounds in ambient aerosols: a case study. Atmos Chem Phys 2024;24(3):1627-39 DOI: 10.5194/acp-24-1627-2024.

[33]       Han Y, Qi Y, Zhong J, Yi Y, Nai H, He D, et al. Deciphering dissolved organic matter characteristics and its fate in a glacier-fed desert river—the Tarim river, China. Environ Res 2024;257 DOI: 10.1016/j.envres.2024.119251.

[34]       Guo B, Liu Y, Zhong KX, Shi Q, He C, Zheng Q, et al. Potential transformation of organic matter by microbes in cryoconite, Tibetan Plateau. Sci China Earth Sci 2024;67(6):1978-89 DOI: 10.1007/s11430-023-1270-0.

[35]       Guan J, Huang J, Sun Y, Li C, Wan Y, Wei G, et al. Understanding petroleum vapor fate and transport through high resolution analysis of two distinct vapor plumes. Sci Total Environ 2024;912 DOI: 10.1016/j.scitotenv.2023.169464.

[36]       Du Y, Che H, Bao Z, Liu Y, Li Q, Hu M, et al. Characterization of Organosulfates (OSs) in typical urban areas in Eastern China: Source, Process, and Volatility. Atmos Res 2024;301 DOI: 10.1016/j.atmosres.2024.107258.

[37]       Chen ZL, Zhang H, Yi Y, He Y, Li P, Wang Y, et al. Dissolved organic matter composition and characteristics during extreme flood events in the Yangtze River Estuary. Sci Total Environ 2024;914 DOI: 10.1016/j.scitotenv.2023.169827.

[38]       Chen ZL, Yi Y, Zhang H, Li P, Wang Y, Yan Z, et al. Differences in Dissolved Organic Matter Molecular Composition along Two Plume Trajectories from the Yangtze River Estuary to the East China Sea. ACS Environ Au 2024;4(1):31-41 DOI: 10.1021/acsenvironau.3c00030.

[39]       Zhou YR, Hao R, Wu YP, He C, Shi Q, Hu RG. Molecular Structures Analysis of Dissolved Organic Matter in Soil and Water of Danjiangkou Reservoir. J Instrum Anal 2023;42(3):283-91 DOI: 10.19969/j.fxcsxb.22111504.

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[47]       Zhang Y, Zhou Z, Zhang X, Guan D, Wang Y, Shi Q, et al. Molecular Characterization of Heavy Olefins in Slurry-Phase Hydrocracking Products Using High-Resolution Mass Spectrometry. Energy Fuels 2023;37(16):11743-53 DOI: 10.1021/acs.energyfuels.3c01603.

[48]       Zhang Q, Wang Y, Zhang X, Mo X, Zhang P, Li H, et al. Dissolved Organic Matter Characteristics and Composition of Saline Lakes in the Badain Jaran Desert, China. ACS Earth Space Chem 2023;7(11):2239-51 DOI: 10.1021/acsearthspacechem.3c00179.

[49]       Zhang Q, Wang Y, Guan P, Zhang P, Mo X, Yin G, et al. Temperature Thresholds of Pyrogenic Dissolved Organic Matter in Heating Experiments Simulating Forest Fires. Environ Sci Technol 2023;57(45):17291-301 DOI: 10.1021/acs.est.3c05265.

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[51]       Zhang B, Liu Z, Xu C, Tan X, Lin Y, Li Y, et al. Molecular Composition and Interfacial Activity of Low Acid High Phenol Crude Oil. Oilfield Chem 2023;40(1):68-75 DOI: 10.19346/j.cnki.1000-4092.2023.01.012.

[52]       Zeng X, He W, Guo H, He C, Shi Q, Shi Q, et al. Molecular Linkage of Dissolved Organic Matter in Groundwater with Prevalence of Chronic Kidney Disease with Unknown Etiology. Expos Health 2023;15(3):489-503 DOI: 10.1007/s12403-022-00509-w.

[53]       Yuan M, Pan S, Jing Z, Poetz S, Shi Q, Han Y, et al. Geochemical distortion on shale oil maturity caused by oil migration: Insights from the non-hydrocarbons revealed by FT-ICR MS. Int J Coal Geol 2023;266 DOI: 10.1016/j.coal.2022.104142.

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[57]       Xiao S, Chen J, Shen Y, Chen Q, Wang Y, Li Y, et al. Molecular characterization of organic matter transformation mediated by microorganisms under anoxic/hypoxic conditions. Sci China Earth Sci 2023;66(4):894-909 DOI: 10.1007/s11430-022-1080-8.

[58]       Wu J, Zhang W, Wang Y, Zhang Y, Shi Q. Identification of sulfur-containing isoprenoids with non-adamantane cage structures in crude oil. Fuel 2023;339 DOI: 10.1016/j.fuel.2023.127390.

[59]       Wu J, Ma C, Zhang W, Chang W, Zhang Y, Shi Q. Molecular characterization of non-polar sulfur compounds in the full boiling range crude oil fractions. Fuel 2023;338 DOI: 10.1016/j.fuel.2022.127323.

[60]       Wang YH, Zhang P, He C, Yu JC, Shi Q, Dahlgren RA, et al. Molecular signatures of soil-derived dissolved organic matter constrained by mineral weathering. Fundam Res 2023;3(3):377-83 DOI: 10.1016/j.fmre.2022.01.032.

[61]       Wang Y, Zhu G, Wang M, Wu J, Fu D, Xie Q, et al. Discovery of novel cage compounds of diamondoids using multi-dimensional mass spectrometry. Chem Eng Sci 2023;273 DOI: 10.1016/j.ces.2023.118677.

[62]       Wang Y, Wu J, Xie L, Yuan M, Jing Z, Pan S, et al. Identification and Geochemical Implication of Sulfur Compounds in an Immature Lacustrine Shale Oil. Energy Fuels 2023;37(17):12946-52 DOI: 10.1021/acs.energyfuels.3c01860.

[63]       Wang Y, Wu J, Li S, Zhang W, Wang P, Wang M, et al. Identification and Geological Implication of Thiols in the Condensate Oils. Energy Fuels 2023;37(16):11675-82 DOI: 10.1021/acs.energyfuels.3c01330.

[64]       Wang Y, Lu J, Zhang X, Zhang X, Zhang B, Wu J, et al. Molecular transformation of heavy oil during slurry phase hydrocracking process: A comparison between thermal cracking and hydrocracking. Fuel 2023;351 DOI: 10.1016/j.fuel.2023.128981.

[65]       Wang K, Pang Y, Yi Y, Yang S, Wang Y, He C, et al. Response of dissolved organic matter chemistry to flood control of a large river reservoir during an extreme storm event. Water Res 2023;230 DOI: 10.1016/j.watres.2023.119565.

[66]       Wang D, Li M, Cheng D, Du Y, Shi Q, Zou X, et al. New biodegradation degree proxies based on acids and neutral nitrogen- and oxygen-containing compounds characterized by high resolution mass spectrometry. Fuel 2023;347 DOI: 10.1016/j.fuel.2023.128438.

[67]       Su R, Li Y, Ma S, Xiang H, Wang Z, Hu Z, et al. Evolution of Hydrocarbons and Carboxylic Acids in Heavy Oil during In Situ Combustion in Xinjiang Oilfield. Energy Fuels 2023;37(18):13751-8 DOI: 10.1021/acs.energyfuels.3c02475.

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[271]     Li XM, Sun GX, Chen SC, Fang Z, Yuan HY, Shi Q, et al. Molecular Chemodiversity of Dissolved Organic Matter in Paddy Soils. Environ Sci Technol 2018;52(3):963-71 DOI: 10.1021/acs.est.7b00377.

[272]     Ji H, Li S, Greenwood P, Zhang H, Pang X, Xu T, et al. Geochemical characteristics and significance of heteroatom compounds in lacustrine oils of the Dongpu Depression (Bohai Bay Basin, China) by negative-ion Fourier transform ion cyclotron resonance mass spectrometry. Mar Pet Geol 2018;97:568-91 DOI: 10.1016/j.marpetgeo.2018.07.035.

[273]     Hu M, Zhang L, He S, Xu C, Shi Q. Collision cross section (CCS) measurement by ion cyclotron resonance mass spectrometry with short-time Fourier transform. Rapid Commun Mass Spectrom 2018;32(9):751-61 DOI: 10.1002/rcm.8096.

[274]     Hao S, Zhu X, Liu Y, Qian F, Fang Z, Shi Q, et al. Production Temperature Effects on the Structure of Hydrochar-Derived Dissolved Organic Matter and Associated Toxicity. Environ Sci Technol 2018;52(13):7486-95 DOI: 10.1021/acs.est.7b04983.

[275]     Geng CX, Cao N, Xu W, He C, Yuan ZW, Liu JW, et al. Molecular Characterization of Organics Removed by a Covalently Bound Inorganic-Organic Hybrid Coagulant for Advanced Treatment of Municipal Sewage. Environ Sci Technol 2018;52(21):12642-8 DOI: 10.1021/acs.est.8b03306.

[276]     Fang Z, Chelme-Ayala P, Shi Q, Xu C, Gamal El-Din M. Degradation of naphthenic acid model compounds in aqueous solution by UV activated persulfate: Influencing factors, kinetics and reaction mechanisms. Chemosphere 2018;211:271-7 DOI: 10.1016/j.chemosphere.2018.07.132.

[277]     Cui C, Zhang L, Ma Y, Billa T, Hou Z, Shi Q, et al. Computer-Aided Gasoline Compositional Model Development Based on GC-FID Analysis. Energy Fuels 2018;32(8):8366-73 DOI: 10.1021/acs.energyfuels.8b01953.

[278]     Cui C, Billa T, Zhang L, Shi Q, Zhao S, Klein MT, et al. Molecular Representation of the Petroleum Gasoline Fraction. Energy Fuels 2018;32(2):1525-33 DOI: 10.1021/acs.energyfuels.7b03588.

[279]     Chen X, Xu C, Zhang W, Ma C, Liu X, Zhao S, et al. Separation and Molecular Characterization of Ketones in a Low-Temperature Coal Tar. Energy Fuels 2018;32(4):4662-70 DOI: 10.1021/acs.energyfuels.7b03630.

[280]     Zhao R, Sun J, Fang Q, Wei Y, Song G, Xu C, et al. Evolution of Acidic Compounds in Crude Oil during in Situ Combustion. Energy Fuels 2017;31(6):5926-32 DOI: 10.1021/acs.energyfuels.7b00453.

[281]     Yuan Z, He C, Shi Q, Xu C, Li Z, Wang C, et al. Molecular Insights into the Transformation of Dissolved Organic Matter in Landfill Leachate Concentrate during Biodegradation and Coagulation Processes Using ESI FT-ICR MS. Environ Sci Technol 2017;51(14):8110-8 DOI: 10.1021/acs.est.7b02194.

[282]     Wang X, Zhang H, Zhang Y, Shi Q, Wang J, Yu J, et al. New Insights into Trihalomethane and Haloacetic Acid Formation Potentials: Correlation with the Molecular Composition of Natural Organic Matter in Source Water. Environ Sci Technol 2017;51(4):2015-21 DOI: 10.1021/acs.est.6b04817.

[283]     Wang M, Zhao S, Ren L, Han Y, Xu C, Chung KH, et al. Refractory Cyclic Sulfidic Compounds in Deeply Hydrodesulfurized Diesels. Energy Fuels 2017;31(4):3838-42 DOI: 10.1021/acs.energyfuels.7b00007.

[284]     Wan Z, Li S, Pang X, Dong Y, Wang Z, Chen X, et al. Characteristics and geochemical significance of heteroatom compounds in terrestrial oils by negative-ion electrospray Fourier transform ion cyclotron resonance mass spectrometry. Org Geochem 2017;111:34-55 DOI: 10.1016/j.orggeochem.2017.05.009.

[285]     Pan Y, Liao Y, Shi Q. Variations of Acidic Compounds in Crude Oil during Simulated Aerobic Biodegradation: Monitored by Semiquantitative Negative-Ion ESI FT-ICR MS. Energy Fuels 2017;31(2):1126-35 DOI: 10.1021/acs.energyfuels.6b02167.

[286]     Hu M, Guo C, Zhang L, Zhao S, Chung KH, Xu C, et al. Petroleum heteroatom compounds in various commercial delayed coking liquids: characterized by FT-ICR MS and GC techniques. Sci China Chem 2017;60(2):284-92 DOI: 10.1007/s11426-016-0168-1.

[287]     He S, Lucio-Vega J, Zhang L, Shi Q, Horton SR, Al-Khattaf S, et al. Integrating Visualization Methods with Chemical Kinetics Model Solution and Editing Tools. Energy Fuels 2017;31(9):9881-9 DOI: 10.1021/acs.energyfuels.7b01202.

[288]     Guo K, Zhang Y, Shi Q, Yu Z. The Effect of Carbon-Supported Nickel Nanoparticles in the Reduction of Carboxylic Acids for in Situ Upgrading of Heavy Crude Oil. Energy Fuels 2017;31(6):6045-55 DOI: 10.1021/acs.energyfuels.7b00809.

[289]     Fang Z, He C, Li Y, Chung KH, Xu C, Shi Q. Fractionation and characterization of dissolved organic matter (DOM) in refinery wastewater by revised phase retention and ion-exchange adsorption solid phase extraction followed by ESI FT-ICR MS. Talanta 2017;162:466-73 DOI: 10.1016/j.talanta.2016.10.064.

[290]     Cao X, Peng B, Ma S, Ni H, Zhang L, Zhang W, et al. Molecular Selectivity in Supercritical CO2 Extraction of a Crude Oil. Energy Fuels 2017;31(5):4996-5002 DOI: 10.1021/acs.energyfuels.7b00415.

[291]     Zhou X, Zhao S, Shi Q. Quantitative Molecular Characterization of Petroleum Asphaltenes Derived Ruthenium Ion Catalyzed Oxidation Product by ESI FT-ICR MS. Energy Fuels 2016;30(5):3758-67 DOI: 10.1021/acs.energyfuels.5b02533.

[292]     Zhang Y, Liao Y, Guo S, Xu C, Shi Q. Molecular Transformation of Crude Oil in Confined Pyrolysis System and Its Impact on Migration and Maturity Geochemical Parameters. Energy Fuels 2016;30(9):6923-32 DOI: 10.1021/acs.energyfuels.6b00841.

[293]     Zhang L, Wang S, Xu Y, Shi Q, Zhao H, Jiang B, et al. Molecular characterization of lake sediment WEON by Fourier transform ion cyclotron resonance mass spectrometry and its environmental implications. Water Res 2016;106:196-203 DOI: 10.1016/j.watres.2016.09.059.

[294]     Wang X, Wang J, Zhang Y, Shi Q, Zhang H, Zhang Y, et al. Characterization of unknown iodinated disinfection byproducts during chlorination/chloramination using ultrahigh resolution mass spectrometry. Sci Total Environ 2016;554-555:83-8 DOI: 10.1016/j.scitotenv.2016.02.157.

[295]     Wang M, Zhao S, Liu X, Shi Q. Molecular Characterization of Thiols in Fossil Fuels by Michael Addition Reaction Derivatization and Electrospray Ionization Fourier Transform Ion Cyclotron Resonance Mass Spectrometry. Anal Chem 2016;88(19):9837-42 DOI: 10.1021/acs.analchem.6b02997.

[296]     Shang H, Liu Y, Shi JC, Shi Q, Zhang WH. Microwave-assisted nickel and vanadium removal from crude oil. Fuel Process Technol 2016;142:250-7 DOI: 10.1016/j.fuproc.2015.09.033.

[297]     Ren L, Han Y, Zhang Y, Zhang Y, Meng X, Shi Q. Spray Injection Direct Analysis in Real Time (DART) Ionization for Petroleum Analysis. Energy Fuels 2016;30(6):4486-93 DOI: 10.1021/acs.energyfuels.6b00018.

[298]     Ni H, Yan L, Ma C, Xu C, Shi Q. Molecular composition of soxhlet NMethyl-2-pyrrolidinone extracts from a lignite. Energy Fuels 2016;30(11):9285-92 DOI: 10.1021/acs.energyfuels.6b01990.

[299]     Ma S, Ma C, Qian K, Zhou Y, Shi Q. Characterization of phenolic compounds in coal tar by gas chromatography/negative-ion atmospheric pressure chemical ionization mass spectrometry. Rapid Commun Mass Spectrom 2016:1806-10 DOI: 10.1002/rcm.7608.

[300]     Lu J, Zhang Y, Shi Q. Ionizing Aromatic Compounds in Petroleum by Electrospray with HCOONH4 as Ionization Promoter. Anal Chem 2016;88(7):3471-5 DOI: 10.1021/acs.analchem.6b00022.

[301]     Ju L, Liu T, Lu J, Zhou Y, Wei Q, Li S, et al. Transformation of Nickel Octaethylporphine in Hydrodemetallization Reactions. Energy Fuels 2016;30(9):6933-41 DOI: 10.1021/acs.energyfuels.6b00952.

[302]     Jiang B, Kuang BY, Liang Y, Zhang J, Huang XHH, Xu C, et al. Molecular composition of urban organic aerosols on clear and hazy days in Beijing: A comparative study using FT-ICR MS. Environ Chem 2016;13(5):888-901 DOI: 10.1071/EN15230.

[303]     He Y, Zhang F, Banat IM, Pu C, Dong H, Shu F, et al. Deposit reduction in a high pour point oil reservoir due to the activity of indigenous bacterial communities. Int Biodeterior Biodegrad 2016;110:87-98 DOI: 10.1016/j.ibiod.2016.02.009.

[304]     Feng S, Zhang L, Wang S, Nadykto AB, Xu Y, Shi Q, et al. Characterization of dissolved organic nitrogen in wet deposition from Lake Erhai basin by using ultrahigh resolution FT-ICR mass spectrometry. Chemosphere 2016;156:438-45 DOI: 10.1016/j.chemosphere.2016.04.039.

[305]     Feng L, Xu J, Kang S, Li X, Li Y, Jiang B, et al. Chemical composition of microbe-derived dissolved organic matter in cryoconite in tibetan plateau glaciers: Insights from fourier transform ion cyclotron resonance mass spectrometry analysis. Environ Sci Technol 2016;50(24):13215-23 DOI: 10.1021/acs.est.6b03971.

[306]     Wang M, Zhu G, Ren L, Liu X, Zhao S, Shi Q. Separation and Characterization of Sulfur Compounds in Ultra-deep Formation Crude Oils from Tarim Basin. Energy Fuels 2015;29(8):4842-9 DOI: 10.1021/acs.energyfuels.5b00897.

[307]     Wang M, Zhao S, Chung KH, Xu C, Shi Q. Approach for selective separation of thiophenic and sulfidic sulfur compounds from petroleum by methylation/demethylation. Anal Chem 2015;87(2):1083-8 DOI: 10.1021/ac503670k.

[308]     Ni H, Hsu CS, Lee P, Wright J, Chen R, Xu C, et al. Supercritical carbon dioxide extraction of petroleum on kieselguhr. Fuel 2015;141:74-81 DOI: 10.1016/j.fuel.2014.09.126.

[309]     Liu T, Lu J, Zhao X, Zhou Y, Wei Q, Xu C, et al. Distribution of vanadium compounds in petroleum vacuum residuum and their transformations in hydrodemetallization. Energy Fuels 2015;29(4):2089-96 DOI: 10.1021/ef502352q.

[310]     Liu H, Mu J, Wang Z, Ji S, Shi Q, Guo A, et al. Characterization of Vanadyl and Nickel Porphyrins Enriched from Heavy Residues by Positive-Ion Electrospray Ionization FT-ICR Mass Spectrometry. Energy Fuels 2015;29(8):4803-13 DOI: 10.1021/acs.energyfuels.5b00763.

[311]     Li Y, Xu C, Chung KH, Shi Q. Molecular characterization of dissolved organic matter and its subfractions in refinery process water by fourier transform ion cyclotron resonance mass spectrometry. Energy Fuels 2015;29(5):2923-30 DOI: 10.1021/acs.energyfuels.5b00333.

[312]     Li Y, Fang Z, He C, Zhang Y, Xu C, Chung KH, et al. Molecular Characterization and Transformation of Dissolved Organic Matter in Refinery Wastewater from Water Treatment Processes: Characterization by Fourier Transform Ion Cyclotron Resonance Mass Spectrometry. Energy Fuels 2015;29(11):6956-63 DOI: 10.1021/acs.energyfuels.5b01446.

[313]     Han Y, Ren L, Xu K, Yang F, Li Y, Cheng T, et al. Supercritical fluid extraction with carbon nanotubes as a solid collection trap for the analysis of polycyclic aromatic hydrocarbons and their derivatives. J Chromatogr A 2015;1395:1-6 DOI: 10.1016/j.chroma.2015.03.038.

[314]     Cui D, Xu C, Chung KH, Shi Q. Potential of Using Coal Tar as a Quenching Agent for Coal Gasification. Energy Fuels 2015;29(11):6964-9 DOI: 10.1021/acs.energyfuels.5b01524.

[315]     Zhao X, Shi Q, Gray MR, Xu C. New vanadium compounds in Venezuela heavy crude oil detected by positive-ion electrospray ionization fourier transform ion cyclotron resonance mass spectrometry. Sci Rep 2014;4 DOI: 10.1038/srep05373.

[316]     Zhang Y, Zhang L, Xu Z, Zhang N, Chung KH, Zhao S, et al. Molecular characterization of vacuum resid and its fractions by Fourier transform ion cyclotron resonance mass spectrometry with various ionization techniques. Energy Fuels 2014;28(12):7448-56 DOI: 10.1021/ef502162b.

[317]     Zhang L, Zhao S, Xu Z, Chung KH, Zhao C, Zhang N, et al. Molecular weight and aggregation of heavy petroleum fractions measured by vapor pressure osmometry and a hindered stepwise aggregation model. Energy Fuels 2014;28(10):6179-87 DOI: 10.1021/ef500749d.

[318]     Zhang L, Zhang Y, Zhao S, Chung KH, Xu C, Shi Q. Effect of apodization on FT-ICR mass spectrometry analysis of petroleum. Int J Mass Spectrom 2014;373:27-33 DOI: 10.1016/j.ijms.2014.08.030.

[319]     Zhang H, Zhang Y, Shi Q, Zheng H, Yang M. Characterization of unknown brominated disinfection byproducts during chlorination using ultrahigh resolution mass spectrometry. Environ Sci Technol 2014;48(6):3112-9 DOI: 10.1021/es4057399.

[320]     Lu H, Shi Q, Ma QL, Shi Y, Liu JZ, Sheng GY, et al. Molecular characterization of sulfur compounds in some specieal sulfur-rich Chinese crude oils by FT-ICR MS. Sci China Earth Sci 2014;57(6):1158-67 DOI: 10.1007/s11430-013-4789-9.

[321]     Jiang B, Liang Y, Xu C, Zhang J, Hu M, Shi Q. Polycyclic aromatic hydrocarbons (PAHs) in ambient aerosols from Beijing: Characterization of low volatile pahs by positive-ion atmospheric pressure photoionization (APPI) coupled with fourier transform ion cyclotron resonance. Environ Sci Technol 2014;48(9):4716-23 DOI: 10.1021/es405295p.

[322]     Bi Y, Wang G, Shi Q, Xu C, Gao J. Compositional changes during hydrodeoxygenation of biomass pyrolysis oil. Energy Fuels 2014;28(4):2571-80 DOI: 10.1021/ef4024405.

[323]     Zhou X, Zhang Y, Zhao S, Hsu CS, Shi Q. Observation of CO2 and solvent adduct ions during negative mode electrospray ionization Fourier transform ion cyclotron resonance mass spectrometric analysis of monohydric alcohols. Rapid Commun Mass Spectrom 2013;27(23):2581-7 DOI: 10.1002/rcm.6721.

[324]     Zhao X, Liu Y, Xu C, Yan Y, Zhang Y, Zhang Q, et al. Separation and characterization of vanadyl porphyrins in Venezuela Orinoco heavy crude oil. Energy Fuels 2013;27(6):2874-82 DOI: 10.1021/ef400161p.

[325]     Zhang T, Zhang L, Zhou Y, Wei Q, Chung KH, Zhao S, et al. Transformation of nitrogen compounds in deasphalted oil hydrotreating: Characterized by electrospray ionization fourier transform-ion cyclotron resonance mass spectrometry. Energy Fuels 2013;27(6):2952-9 DOI: 10.1021/ef400154u.

[326]     Zhang L, Shi Q, Zhao C, Zhang N, Chung KH, Xu C, et al. Hindered stepwise aggregation model for molecular weight determination of heavy petroleum fractions by vapor pressure osmometry (VPO). Energy Fuels 2013;27(3):1331-6 DOI: 10.1021/ef302194x.

[327]     Zhang L, Li S, Han L, Sun X, Xu Z, Shi Q, et al. Coking reactivity of laboratory-scale unit for two heavy petroleum and their supercritical fluid extraction subfractions. Ind Eng Chem Res 2013;52(16):5593-600 DOI: 10.1021/ie302891b.

[328]     Xu CM, Liu Y, Zhao SQ, Shi Q. Compositional analysis of petroleum asphaltenes by negative ion electrospray high resolution FT-ICR mass spectrometry. Zhongguo Shiyou Daxue Xuebao (Ziran Kexue Ban) 2013;37(5):190-5 DOI: 10.3969/j.issn.1673-5005.2013.05.028.

[329]     Tong J, Liu J, Han X, Shi Q, Jiang X. Influence of heating rate on basic nitrogen-containing species content in Dachengzi shale oil studied by positive-ion electrospray ionization FT-ICR mass spectrometry. Oil Shale 2013;30(1):76-89 DOI: 10.3176/oil.2013.1.07.

[330]     Stevens D, Shi Q, Hsu CS. Novel analytical technique for petroleum biomarker analysis. Energy Fuels 2013;27(1):167-71 DOI: 10.1021/ef301645g.

[331]     Shi Q, Pan N, Long H, Cui D, Guo X, Long Y, et al. Characterization of middle-temperature gasification coal tar. Part 3: Molecular composition of acidic compounds. Energy Fuels 2013;27(1):108-17 DOI: 10.1021/ef301431y.

[332]     Pan Y, Liao Y, Shi Q, Hsu CS. Acidic and neutral polar NSO compounds in heavily biodegraded oils characterized by negative-ion ESI FT-ICR MS. Energy Fuels 2013;27(6):2960-73 DOI: 10.1021/ef400191h.

[333]     Ni H, Hsu CS, Ma C, Shi Q, Xu C. Separation and characterization of olefin/paraffin in coal tar and petroleum coker oil. Energy Fuels 2013;27(9):5069-75 DOI: 10.1021/ef400470v.

[334]     Lu H, Shi Q, Lu J, Sheng G, Peng P, Hsu CS. Petroleum sulfur biomarkers analyzed by comprehensive two-dimensional gas chromatography sulfur-specific detection and mass spectrometry. Energy Fuels 2013;27(12):7245-51 DOI: 10.1021/ef401239u.

[335]     Liu D, Wang J, Fu Y, Kong X, Li M, Shi Q. Performance of microbial degradation of Gudong oil and its fractions in petroleum contaminated soil. Chin J Environ Eng 2013;7(8):3223-30.

[336]     Li SM, Shi Q, Zhang BS, Zhang HZ, Pan N, Zhao M, et al. Formation mechanism of the oils in Tazhong-4 Oilfield analyzed by high resolution mass spectrum. Diqiu Kexue Zhongguo Dizhi Daxue Xuebao 2013;38(1):94-104 DOI: 10.3799/dqkx.2013.009.

[337]     Chen F, Liu Q, Xu Z, Sun X, Shi Q, Zhao S. Adsorption kinetics and thermodynamics of vanadyl etioporphyrin on asphaltene in pentane. Energy Fuels 2013;27(11):6408-18 DOI: 10.1021/ef400533t.

[338]     Zhou X, Shi Q, Zhang Y, Zhao S, Zhang R, Chung KH, et al. Analysis of saturated hydrocarbons by redox reaction with negative-ion electrospray fourier transform ion cyclotron resonance mass spectrometry. Anal Chem 2012;84(7):3192-9 DOI: 10.1021/ac203035k.

[339]     Zhao Y, Zhao S, Shi Q, Xu C. Application of chemometrics technique in the prediction of FCC product distributions processing heavy oil. Pet Process Petrochem 2012;43(6):88-92.

[340]     Zhao Y, Xu C, Zhao S, Shi Q. Pattern recognition technology application in intelligent processing of heavy oil. Energy Fuels 2012;26(12):7251-6 DOI: 10.1021/ef300968k.

[341]     Zhang L, Xu Z, Shi Q, Sun X, Zhang N, Zhang Y, et al. Molecular characterization of polar heteroatom species in Venezuela Orinoco petroleum vacuum residue and its supercritical fluid extraction subfractions. Energy Fuels 2012;26(9):5795-803 DOI: 10.1021/ef3009663.

[342]     Zhang H, Zhang Y, Shi Q, Ren S, Yu J, Ji F, et al. Characterization of low molecular weight dissolved natural organic matter along the treatment trait of a waterworks using Fourier transform ion cyclotron resonance mass spectrometry. Water Res 2012;46(16):5197-204 DOI: 10.1016/j.watres.2012.07.004.

[343]     Zhang H, Zhang Y, Shi Q, Hu J, Chu M, Yu J, et al. Study on transformation of natural organic matter in source water during chlorination and its chlorinated products using ultrahigh resolution mass spectrometry. Environ Sci Technol 2012;46(8):4396-402 DOI: 10.1021/es203587q.

[344]     Pan N, Cui D, Li R, Shi Q, Chung KH, Long H, et al. Characterization of middle-temperature gasification coal tar. Part 1: Bulk properties and molecular compositions of distillates and basic fractions. Energy Fuels 2012;26(9):5719-28 DOI: 10.1021/ef3007323.

[345]     Liao Y, Shi Q, Hsu CS, Pan Y, Zhang Y. Distribution of acids and nitrogen-containing compounds in biodegraded oils of the Liaohe Basin by negative ion ESI FT-ICR MS. Org Geochem 2012;47:51-65 DOI: 10.1016/j.orggeochem.2012.03.006.

[346]     Li S, Shi Q, Pang X, Zhang B, Zhang H. Origin of the unusually high dibenzothiophene oils in Tazhong-4 Oilfield of Tarim Basin and its implication in deep petroleum exploration. Org Geochem 2012;48:56-80 DOI: 10.1016/j.orggeochem.2012.04.008.

[347]     Zhu X, Shi Q, Zhang Y, Pan N, Xu C, Chung KH, et al. Characterization of nitrogen compounds in coker heavy gas oil and its subfractions by liquid chromatographic separation followed by fourier transform ion cyclotron resonance mass spectrometry. Energy Fuels 2011;25(1):281-7 DOI: 10.1021/ef101328n.

[348]     Zhang Y, Shi Q, Li A, Chung KH, Zhao S, Xu C. Partitioning of crude oil acidic compounds into subfractions by extrography and identification of isoprenoidyl phenols and tocopherols. Energy Fuels 2011;25(11):5083-9 DOI: 10.1021/ef2011854.

[349]     Zhang N, Zhao SQ, Shi Q, Xu ZM, Sun XW, Xu CM. Heteroatomic compositional analysis of Venezuela Orinoco AR and the visbreaking product by negative ion ESI-FT-ICR MS. Ranliao Huaxue Xuebao J Fuel Chem Technol 2011;39(1):37-41.

[350]     Liang Y, Shi Q, Liu X, He J. Study on the cut points of light and heavy gasoline fractions for selective hydrodesulfurization of FCC gasoline. Pet Process Petrochem 2011;42(5):40-4.

[351]     Li ZK, Wang G, Shi Q, Xu CM, Gao JS. Retardation effect of basic nitrogen compounds on hydrocarbons catalytic cracking in coker gas oil and their structural identification. Ind Eng Chem Res 2011;50(7):4123-32 DOI: 10.1021/ie102117x.

[352]     Li ZK, Gao JS, Wang G, Shi Q, Xu CM. Influence of nonbasic nitrogen compounds and condensed aromatics on coker gas oil catalytic cracking and their characterization. Ind Eng Chem Res 2011;50(15):9415-24 DOI: 10.1021/ie2003973.

[353]     Li S, Pang X, Shi Q, Zhang B, Zhang H, Pan N, et al. Origin of the unusually high dibenzothiophene concentrations in Lower Ordovician oils from the Tazhong Uplift, Tarim Basin, China. Petrol Sci 2011;8(4):382-91 DOI: 10.1007/s12182-011-0170-9.

[354]     Li S, Pang X, Shi Q, Zhang B, Zhang H, Pan N, et al. Geochemical characteristics of crude oils from the Tarim Basin by Fourier transform Ion cyclotron resonance mass spectrometry. Energy Explor Exploit 2011;29(6):711-42 DOI: 10.1260/0144-5987.29.6.711.

[355]     Zhang Y, Xu C, Shi Q, Zhao S, Chung KH, Hou D. Tracking neutral nitrogen compounds in subfractions of crude oil obtained by liquid chromatography separation using negative-ion electrospray ionization fourier transform ion cyclotron resonance mass spectrometry. Energy Fuels 2010;24(12):6321-6 DOI: 10.1021/ef1011512.

[356]     Zhang N, Zhao SQ, Sun XW, Xu ZM, Shi Q, Xu CM. An analysis of visbreaking of Venezuela AR by ultrahigh-resolution Neg ESI FT-ICR MS. Huagong Xiandai 2010;30(4):89-92+6.

[357]     Shi Q, Zhao S, Xu Z, Chung KH, Zhang Y, Xu C. Distribution of acids and neutral nitrogen compounds in a Chinese crude oil and its fractions: Characterized by negative-ion electrospray ionization Fourier transform ion cyclotron resonance mass spectrometry. Energy Fuels 2010;24(7):4005-11 DOI: 10.1021/ef1004557.

[358]     Shi Q, Yan Y, Wu X, Li S, Chung KH, Zhao S, et al. Identification of dihydroxy aromatic compounds in a low-temperature pyrolysis coal tar by gas chromatography-mass spectrometry (GC-MS) and Fourier transform ion cyclotron resonance mass spectrometry (FT-ICR MS). Energy Fuels 2010;24(10):5533-8 DOI: 10.1021/ef1007352.

[359]     Shi Q, Pan N, Liu P, Chung KH, Zhao S, Zhang Y, et al. Characterization of sulfur compounds in oilsands bitumen by methylation followed by positive-ion electrospray ionization and fourier transform ion cyclotron resonance mass spectrometry. Energy Fuels 2010;24(5):3014-9 DOI: 10.1021/ef9016174.

[360]     Li Z, Wang G, Liu Y, Shi Q, Gao J. Structure analysis of key components in coker gas oil and their effects on catalytic cracking reaction. Shiyou Xuebao Shiyou Jiagong 2010;26(5):691-9 DOI: 10.3969/j.issn.1001-8719.2010.05.006.

[361]     Li M, Cheng D, Pan X, Dou L, Hou D, Shi Q, et al. Characterization of petroleum acids using combined FT-IR, FT-ICR-MS and GC-MS: Implications for the origin of high acidity oils in the Muglad Basin, Sudan. Org Geochem 2010;41(9):959-65 DOI: 10.1016/j.orggeochem.2010.03.006.

[362]     Cheng DS, Dou LR, Wan LK, Shi Q. Formation mechanism analysis of Sudan high acidity oils by electrospray ionization fourier transform ion cyclotron resonance mass spectrometry. Yanshi Xuebao/Acta Petrol Sin 2010;26(4):1303-12.

[363]     Shi Q, Xu C, Zhao S, Chung KH. Characterization of heteroatoms in residue fluid catalytic cracking (RFCC) diesel by gas chromatography and mass spectrometry. Energy Fuels 2009;23(12):6062-9 DOI: 10.1021/ef900783z.

[364]     Gao LP, Liu P, Gu T, Xu CM, Hai LQ, Shi Q. Characterization of sulfur compounds in diesel fractions. Ranliao Huaxue Xuebao J Fuel Chem Technol 2009;37(2):183-8.