scholarly journals Distribution of nitrogen and oxygen compounds in shale oil distillates and their catalytic cracking performance

2020 ◽  
Vol 17 (6) ◽  
pp. 1764-1778
Author(s):  
Xiao-Bo Chen ◽  
Xin-Yang Zhang ◽  
Ru-Meng Qin ◽  
Sheng-Jie Shan ◽  
Pan-Deng Xia ◽  
...  
Keyword(s):  
Catalytic Cracking ◽  
Carbon Number ◽  
Negative Ion ◽  
Ion Cyclotron Resonance ◽  
Shale Oil ◽  
Basic Nitrogen ◽  
Liquid Products ◽  
Cracking Performance ◽  
Heteroatomic Compounds ◽  
Ft Icr Ms

AbstractThe positive- and negative-ion electrospray ionization (ESI) coupled with Fourier transform-ion cyclotron resonance mass spectrometry (FT-ICR MS) was employed to identify the chemical composition of heteroatomic compounds in four distillates of Fushun shale oil, and their catalytic cracking performance was investigated. There are nine classes of basic nitrogen compounds (BNCs) and eleven classes of non-basic heteroatomic compounds (NBHCs) in the different distillates. The dominant BNCs are mainly basic N1 class species. The dominant NBHCs are mainly acidic O2 and O1 class species in the 300–350 °C, 350–400 °C, and 400–450 °C distillates, while the neutral N1, N1O1 and N2 compounds become relatively abundant in the > 450 °C fraction. The basic N1 compounds and acidic O1 and O2 compounds are separated into different distillates by the degree of alkylation (different carbon number) but not by aromaticity (different double-bond equivalent values). The basic N1O1 and N2 class species and neutral N1 and N2 class species are separated into different distillates by the degrees of both alkylation and aromaticity. After the catalytic cracking of Fushun shale oil, the classes of BNCs in the liquid products remain unchanged, while the classes and relative abundances of NBHCs vary significantly.

scholarly journals Profiling Murchison Soluble Organic Matter for New Organic Compounds with APPI- and ESI-FT-ICR MS

Life ◽  
2019 ◽  
Vol 9 (2) ◽  
pp. 48 ◽  
Author(s):  
Jasmine Hertzog ◽  
Hiroshi Naraoka ◽  
Philippe Schmitt-Kopplin
Keyword(s):  
Organic Matter ◽  
Negative Ion ◽  
Ion Cyclotron Resonance ◽  
Ms Analysis ◽  
Major Interest ◽  
Polycyclic Aromatic ◽  
Soluble Organic Fraction ◽  
Negative Ion Mode ◽  
Ft Icr Ms ◽  
Ft Icr

The investigation of the abundant organic matter in primitive meteorite such as carbonaceous chondrites is of major interest in the field of origin of life. In this study, the soluble organic fraction of the Murchison meteorite was analyzed by atmospheric pressure photoionization (APPI) and electrospray ionization (ESI) Fourier transform ion cyclotron resonance mass spectrometry (FT-ICR MS), in both detection modes. Such an approach ensured that we obtained an extensive description of the organic matter of the CM2 meteorite. Indeed, while in total close to 16,000 unique features were assigned, only 4% are common to all analyses, illustrating the complementarity of both the detection modes and the ionization sources. ESI FT-ICR MS analysis, in negative-ion mode, ensured to observe specifically CHOS and CHNOS species, whereas the positive-ion mode is more dedicated to the detection of CHNO and CHN species. Moreover, new organomagnesium components were observed in (+) ESI. Eventually, (+) APPI FT-ICR MS analysis was a preferred method for the detection of less polar or nonpolar species such as polycyclic aromatic hydrocarbons but also heteroatom aromatic species composing the organic matter of Murchison.

scholarly journals Pyrolysis Temperature Effect on Compositions of Neutral Nitrogen and Acidic Species in Shale Oil Using Negative-Ion ESI FT-ICR MS

ACS Omega ◽  
2020 ◽  
Vol 5 (37) ◽  
pp. 23940-23950 ◽  
Author(s):  
Da Cui ◽  
Hongyun Chang ◽  
Xu Zhang ◽  
Shuo Pan ◽  
Qing Wang
Keyword(s):  
Temperature Effect ◽  
Pyrolysis Temperature ◽  
Negative Ion ◽  
Shale Oil ◽  
Ft Icr Ms ◽  
Ft Icr

scholarly journals A diffusion anisotropy descriptor links morphology effects of H-ZSM-5 zeolites to their catalytic cracking performance

2021 ◽  
Vol 4 (1) ◽  
Author(s):  
Xiaoliang Liu ◽  
Jing Shi ◽  
Guang Yang ◽  
Jian Zhou ◽  
Chuanming Wang ◽  
...  
Keyword(s):  
Catalytic Activity ◽  
Catalytic Cracking ◽  
Catalytic Performance ◽  
Zeolite Catalysts ◽  
Time Resolved ◽  
Cracking Performance ◽  
Morphology Effect ◽  
Ft Ir ◽  
The Difference ◽  
Dynamics Simulations

AbstractZeolite morphology is crucial in determining their catalytic activity, selectivity and stability, but quantitative descriptors of such a morphology effect are challenging to define. Here we introduce a descriptor that accounts for the morphology effect in the catalytic performances of H-ZSM-5 zeolite for C4 olefin catalytic cracking. A series of H-ZSM-5 zeolites with similar sheet-like morphology but different c-axis lengths were synthesized. We found that the catalytic activity and stability is improved in samples with longer c-axis. Combining time-resolved in-situ FT-IR spectroscopy with molecular dynamics simulations, we show that the difference in catalytic performance can be attributed to the anisotropy of the intracrystalline diffusive propensity of the olefins in different channels. Our descriptor offers mechanistic insight for the design of highly effective zeolite catalysts for olefin cracking.

scholarly journals Role of Catalyst in Optimizing Fluid Catalytic Cracking Performance During Cracking of H-Oil-Derived Gas Oils

ACS Omega ◽  
2021 ◽  
Author(s):  
Dicho Stratiev ◽  
Ivelina Shishkova ◽  
Mihail Ivanov ◽  
Rosen Dinkov ◽  
Borislav Georgiev ◽  
...  
Keyword(s):  
Catalytic Cracking ◽  
Fluid Catalytic Cracking ◽  
Cracking Performance

scholarly journals Comparing Crude Oils with Different API Gravities on a Molecular Level Using Mass Spectrometric Analysis. Part 1: Whole Crude Oil

Energies ◽  
2018 ◽  
Vol 11 (10) ◽  
pp. 2766 ◽  
Author(s):  
Jandyson Santos ◽  
Alberto Wisniewski Jr. ◽  
Marcos Eberlin ◽  
Wolfgang Schrader
Keyword(s):  
Crude Oil ◽  
Atmospheric Pressure ◽  
Molecular Level ◽  
Carbon Number ◽  
Mass Spectrometric ◽  
Oil Refining ◽  
Crude Oils ◽  
Spectrometric Analysis ◽  
Ft Icr Ms ◽  
Ft Icr

Different ionization techniques based on different principles have been applied for the direct mass spectrometric (MS) analysis of crude oils providing composition profiles. Such profiles have been used to infer a number of crude oil properties. We have tested the ability of two major atmospheric pressure ionization techniques, electrospray ionization (ESI(±)) and atmospheric pressure photoionization (APPI(+)), in conjunction with Fourier transform ion cyclotron resonance mass spectrometry (FT-ICR MS). The ultrahigh resolution and accuracy measurements of FT-ICR MS allow for the correlation of mass spectrometric (MS) data with crude oil American Petroleum Institute (API) gravities, which is a major quality parameter used to guide crude oil refining, and represents a value of the density of a crude oil. The double bond equivalent (DBE) distribution as a function of the classes of constituents, as well as the carbon numbers as measured by the carbon number distributions, were examined to correlate the API gravities of heavy, medium, and light crude oils with molecular FT-ICR MS data. An aromaticity tendency was found to directly correlate the FT-ICR MS data with API gravities, regardless of the ionization technique used. This means that an analysis on the molecular level can explain the differences between a heavy and a light crude oil on the basis of the aromaticity of the compounds in different classes. This tendency of FT-ICR MS with all three techniques, namely, ESI(+), ESI(−), and APPI(+), indicates that the molecular composition of the constituents of crude oils is directly associated with API gravity.

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