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泰科电子安普——EtherSeal布线系统
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《智能建筑与城市信息》 2004年第5期82-84,共3页
关键词 密封套件 插座 连接器 etherseal 布线系统 泰科电子安普公司
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泰科电子安普EtherSeal布线系统
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《计算机网络世界》 2004年第5期42-43,共2页
随着以太网系统得到更广泛的应用.在恶劣环境中网络的使用逐渐被提到议事日程上来,所谓所谓的恶劣环境主要包括:温度和湿度过高或过低的环境、灰尘比较多的环境、连接系统需要经受比较大震动的环境、较强电磁干扰和有腐蚀性化学物质... 随着以太网系统得到更广泛的应用.在恶劣环境中网络的使用逐渐被提到议事日程上来,所谓所谓的恶劣环境主要包括:温度和湿度过高或过低的环境、灰尘比较多的环境、连接系统需要经受比较大震动的环境、较强电磁干扰和有腐蚀性化学物质的环境。 展开更多
关键词 以太网系统 恶劣环境 泰科电子安普公司 etherseal布线系统 信息模块 插头套件 线上对接器
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泰科电子推出适合在恶劣环境中使用的新型EtherSeal布线系统
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《计算机网络世界》 2004年第2期42-42,共1页
泰科电子/安普推出最新开发的EtherSeal连接系统。该系统可以保证在恶劣环境中的通信传输质量。所谓的恶劣环境主要包括:温度和湿度过高或过低的环境、灰尘比较多的环境。
关键词 etherseal布线系统 通信传输质量 数据传输率 通信网 泰科电子公司
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冠醚PVC膜锂离子选择电极的研究
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作者 万惠杰 汪玉庭 +2 位作者 谢志水 周建军 黄载福 《化学研究与应用》 CAS CSCD 1990年第1期75-79,共5页
以冠醚为中性载体的PVC膜锂电极的研究,近年来十分活跃,所用的冠醚有16-冠、14-冠-4、12-冠-4等,但这些电极受一价离子的干扰严重,线性范围在10°~10~3M LiCl之间,Kimura等和黄枢等分别以长链烷基取代14-冠-4和苯并12-冠为活性物... 以冠醚为中性载体的PVC膜锂电极的研究,近年来十分活跃,所用的冠醚有16-冠、14-冠-4、12-冠-4等,但这些电极受一价离子的干扰严重,线性范围在10°~10~3M LiCl之间,Kimura等和黄枢等分别以长链烷基取代14-冠-4和苯并12-冠为活性物质研制的锂电极,抗一价离子的干扰性能有较大提高。为了探讨冠醚结构对电极能的影响,我们合成了七个新型冠醚Ⅰ—Ⅶ,并以它们为中性载体,研制了PVC膜锂离子择电极。 展开更多
关键词 CROWN ETHERS lithium ION ION selective electrode.
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Mechanism of chain propagation for the synthesis of polyoxymethylene dimethyl ethers 被引量:36
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作者 Yupei Zhao Zheng Xu +2 位作者 Hui Chen Yuchuan Fu Jianyi Shen 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2013年第6期833-836,共4页
Polyoxymethylene dimethyl ethers(PODE)were synthesized from the reaction of paraformaldehyde with dimethoxymethane(DMM)over different acid catalysts at different conditions.Products were found to follow the Schulz-Flo... Polyoxymethylene dimethyl ethers(PODE)were synthesized from the reaction of paraformaldehyde with dimethoxymethane(DMM)over different acid catalysts at different conditions.Products were found to follow the Schulz-Flory distribution law.The chain propagation proceeds through the insertion of an individual segment of CH2O one by one,while the simultaneous insertion of a few CH2O segments or their assembly is unlikely.Due to the restriction of this law,it is difficult to increase the selectivity to the desired products(e.g.,PODE3 4). 展开更多
关键词 polyoxymethylene dimethyl ethers (PODE) diesel additive chain propagation product distribution Schulz-Flory law
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Chemical equilibrium controlled synthesis of polyoxymethylene dimethyl ethers over sulfated titania 被引量:18
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作者 Huaju Li Huanling Song +2 位作者 Feng Zhao Liwei Chen Chungu Xia 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2015年第2期239-244,共6页
The chemical equilibrium and reaction kinetic behavior in the synthesis of polyoxymethylene dimethyl ethers (DMMn) were investigated over sulfated titania in order to reveal the decisive factor controlling the react... The chemical equilibrium and reaction kinetic behavior in the synthesis of polyoxymethylene dimethyl ethers (DMMn) were investigated over sulfated titania in order to reveal the decisive factor controlling the reaction. The results showed that the molar ratio of adjacent DMMn products in equilibrium solution had the same value, which depended absolutely on the reaction temperature. Meanwhile, the reactions had the same DMMn products distributions under varied reaction conditions. The equilibrium constants of the related step-wise reactions for DMMn formation were equal, which were calculated based on the bulk compositions of the reaction solution. And thus, the selectivity to DMMn was mainly controlled by the chemical equilibrium, i.e., thermodynamic control. In brief, the present results provide some guidance for future synthesis of DMMn. 展开更多
关键词 polyoxymethylene dimethyl ethers sulfated titania chemical equilibrium reaction kinetic molar ratio
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Ecotoxicological effects of mixed pollutants resulted from e-wastes recycling and bioaccumulation of polybrominated diphenyl ethers in Chinese loach(Misgurnus anguillicaudatus) 被引量:6
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作者 QIN Xiaofei XIA Xijuan +8 位作者 LI Yan ZHAO Yaxian YANG Zhongzhi FU Shan TI-AN Mi ZHAO Xingru QIN Zhanfen XU Xiaobai YANG Yongjian 《Journal of Environmental Sciences》 SCIE EI CAS CSCD 2009年第12期1695-1701,共7页
To understand potential ecotoxicological effects of electrical and electronic equipment waste (e-waste) recycling and polybrominated diphenyl ethers (PBDEs) bioaccumulation in loaches, a semi-field experiment usin... To understand potential ecotoxicological effects of electrical and electronic equipment waste (e-waste) recycling and polybrominated diphenyl ethers (PBDEs) bioaccumulation in loaches, a semi-field experiment using Chinese loach (Misgurnus anguiUicaudatus) as experimental fish was performed. Larval loaches were kept in net-cage for three months in an e-wastes recycling site and a reference site in Southeastern China. There was significant difference of the survival rate between the loaches from the e-wastes recycling site (27%, 19/70) and from reference site (70%, 49/70). Histopathological responses were also found in all the livers examined in loaches from the e-wastes recycling site. These results showed that mixed pollutants resulted from e-wastes recycling led to ecotoxicological effects on loaches. The bioaccumulation of polybrominated diphenyl ethers (PBDEs), the main pollutants in e-waste, in loaches was also studied, the mean concentration of total PBDEs in sediment was 6726.17 ng/g wet weight and in water samples was 4.08 ng/L (dissolved phase). BDE 209 was the dominant congener in sediment and with relatively high concentration in water. Relatively low concentration of BDE 209 (less than 0.01% of total PBDEs) and high concentration of BDE47 (up to 39.34% of total PBDEs) were detected in loaches. 展开更多
关键词 e-wastes LOACH ecotoxicological effects polybrominated diphenyl ethers semi-field experiment
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A Synthesis, Process Optimization, and Mechanism Investigation for the Formation of Polyoxymethylene Dimethyl Ethers 被引量:4
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作者 Yang Liu Yan Wang Wangfeng Cai 《Transactions of Tianjin University》 EI CAS 2019年第1期1-8,共8页
Polyoxymethylene dimethyl ethers(DMM_n) are promising diesel additives. The synthesis of DMM_n from methylal(DMM) and paraformaldehyde over the NKC-9 acidic ion-exchange resin catalyst was investigated. Many unrecycla... Polyoxymethylene dimethyl ethers(DMM_n) are promising diesel additives. The synthesis of DMM_n from methylal(DMM) and paraformaldehyde over the NKC-9 acidic ion-exchange resin catalyst was investigated. Many unrecyclable by-products such as methyl formate, dimethyl ether and formic acid were produced in the reaction. To increase the selectivity of the desired products DMM_(3-6) and reduce the amount of unrecyclable by-products, the effects of reaction temperature, time, pressure and the molar ratio of the raw materials were evaluated through a series of single factor experiments. Experiments revealed that trace amount of water could suppress the formation of unrecyclable by-products, and the optimum initial water content(less than 2 wt%) was investigated. In addition, the synthetic process needs to go through the polyoxymethylene hemiformals intermediate stage, and then the DMM_n were obtained when polyoxymethylene hemiformals reacted with methanol. Ultimately, a possible mechanism is proposed to describe the formation of DMM_n from polyoxymethylene hemiformals in detail, in which it is revealed that the formation of carbocation intermediates is important in the reaction processes. 展开更多
关键词 POLYOXYMETHYLENE DIMETHYL ETHERS PARAFORMALDEHYDE METHYLAL Diesel additive POLYOXYMETHYLENE hemiformals
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Zeolite-assisted etherification of glycerol with butanol for biodiesel oxygenated additives production 被引量:4
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作者 C.Cannilla G.Bonura +5 位作者 S.Maisano L.Frusteri M.Migliori G.Giordano S.Todaro F.Frusteri 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2020年第9期136-144,I0005,共10页
This research was focused on the valorisation of glycerol,exploring the feasibility of an efficient route for oxygenated additives production based on its etherification with bio-butanol.A home-made BEA zeolite sample... This research was focused on the valorisation of glycerol,exploring the feasibility of an efficient route for oxygenated additives production based on its etherification with bio-butanol.A home-made BEA zeolite sample with a tuneable acidity has been proposed as the catalytic system,being tested in a stirred reactor under different etherification conditions.Although a reaction temperature as high as 200℃resulted to be beneficial in terms of glycerol conversion(-90%),only by operating at milder conditions the product selectivity to glycerol-ethers can be better controlled,in order to obtain a bio-fuel complying with the requirements for mixing with fossil diesel or biodiesel,without any need of purification from large amount of by-products.A comprehensive identification of all the compounds formed during the reaction was performed by a GC-MS analysis,on the basis of the complex network of consecutive and parallel reaction paths leading not only to the desired ethers,but also to many side products not detected in similar acid-catalyzed reactions in liquid phase and not available in the most used mass-spectra libraries. 展开更多
关键词 GLYCEROL BUTANOL BEA GC-MS analysis Acid catalysts Biofuels Butyl glycerol ethers
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Regioselective tetrahydropyranylation of alcohols catalyzed by Fe(HSO_4)_3 被引量:4
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作者 Farhad Shirini Mohammad Ali Zolfigol Abdol-Reza Abri 《Chinese Chemical Letters》 SCIE CAS CSCD 2007年第7期803-806,共4页
Alcohols are selectively and efficiently protected as their tetrahydropranyl ethers in the presence of a catalytic amount of Fe(HSO4)3 in good to high yields. All reactions are performed under mild and completely he... Alcohols are selectively and efficiently protected as their tetrahydropranyl ethers in the presence of a catalytic amount of Fe(HSO4)3 in good to high yields. All reactions are performed under mild and completely heterogeneous reaction conditions. 展开更多
关键词 ALCOHOLS TETRAHYDROPYRANYLATION Tetrahydropyranyl ethers Fe(HSO4)3 Heterogeneous reaction conditions
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Suppressing Li Dendrites via Electrolyte Engineering by Crown Ethers for Lithium Metal Batteries 被引量:4
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作者 Shanqing Zhang 《Nano-Micro Letters》 SCIE EI CAS CSCD 2020年第11期226-228,共3页
Electrolyte engineering is considered as an effective strategy to establish stable solid electrolyte interface(SEI),and thus to suppress the growth of lithium dendrites.In a recent study reported in Advanced Functiona... Electrolyte engineering is considered as an effective strategy to establish stable solid electrolyte interface(SEI),and thus to suppress the growth of lithium dendrites.In a recent study reported in Advanced Functional Materials by Ma group,discovered that strong coordination force could be founded between 15-Crown-5 ether(15-C-5) and Li+,which facilitates the crown ether(15-C-1) to participate in the solvation structure of Li+ in the electrolyte for the same purpose.Such a novel strategy might impact the design of highperformance and safe lithium metal batteries(LMB s). 展开更多
关键词 Li dendrites Crown ethers Lithium metal batteries ELECTROLYTE
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Occurrence of polybrominated diphenyl ethers in fish and shellfish downstream from electronic-waste recycling plants 被引量:3
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作者 Jinhua Jiang Shidi Shi Tao Chen 《Journal of Environmental Sciences》 SCIE EI CAS CSCD 2010年第5期723-730,共8页
We measured 39 polybrominated diphenyl ethers (PBDEs) in the muscle tissue of three species of fish (Sciaenops ocellatus,Sparus macrocephalus,and Lateolabrax japonicus) and four species of shellfish (Tegillarca g... We measured 39 polybrominated diphenyl ethers (PBDEs) in the muscle tissue of three species of fish (Sciaenops ocellatus,Sparus macrocephalus,and Lateolabrax japonicus) and four species of shellfish (Tegillarca granosa,Cyclina sinensis,Sinonovacula constricta,and Ostrea cucullata) that were collected downstream of electronic-waste recycling plants in Taizhou,China.A total of 24 PBDE congeners (PBDE 24) in the samples were detected.The PBDE 24 (total PBDE) ranged from 545.4 to 1688.7 ng/kg ww (wet weight).The mean PBDE 24 concentration was 1382.6 ng/kg ww in fish and 858.1 ng/kg ww in shellfish.The lower brominated congeners were detected at relatively high concentrations in all species.The penta-products,produced from e-waste,were found at relatively low levels.A principal component analysis suggested a significant correlation among di-,tri-,tetra-,and hepta-BDEs for the three species of fish.Similarly,we found a significant correlation between mono-and tri-BDEs in the shellfish.Our results suggested that the processes of PBDE metabolism and elimination were similar in both fish and shellfish.In addition,the primary source of PBDEs appeared to be from the debromination of high brominated PBDEs. 展开更多
关键词 BIOACCUMULATION polybrominated diphenyl ethers CONGENER
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A QSRR Study on the Relative Retention Time of Halogenated Methyl-phenyl Ethers 被引量:5
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作者 XU Hui-Ying YU Qing-Sen +3 位作者 ZOU Jian-Wei WANG Yan-Hua WANG Hong-Qing CHEN Xue-Song 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 北大核心 2006年第7期811-817,共7页
Halogenated methyl-phenyl ethers (anisoles) are ubiquitous organic compounds in the environment. In the present study, geometrical optimization and electrostatic potential calculations have been performed for 42 hal... Halogenated methyl-phenyl ethers (anisoles) are ubiquitous organic compounds in the environment. In the present study, geometrical optimization and electrostatic potential calculations have been performed for 42 halogenated anisoles at the HF/6-31 G^* level. A number of statistically based parameters have been obtained. By multiple regression method, linear relationships between the gas-chromatographic relative retention time (RRT) and structural descriptors have been established for the training set of 32 halogenated anisoles. The result showed that the parameters derived from electrostatic potentials (ESPs) together with the molecular volume (Vmc) could be well used to express the quantitative structure-RRT relationships of halogenated anisoles. The best two-variable regression model gives a correlation coefficient of 0.980 and a standard deviation of 0.07, and the leave-one-out cross-validated correlation coefficient is 0.975. The goodness of the model has been further validated through exploring the predictive power for the testing set of 10 halogenated anisoles. 展开更多
关键词 halogenated methyl-phenyl ethers (anisoles) molecular electrostatic potentials (ESPs) relative retention time (RRT) QSRR
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Determination of brominated diphenyl ethers in atmospheric particulate matter using selective pressurized liquid extraction and gas chromatography–mass spectrometry with a negative chemical ionization 被引量:3
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作者 Qian Zhang Yongxiao Wang +1 位作者 Guilin Han Tao Liang 《Acta Geochimica》 EI CAS CSCD 2017年第3期531-534,共4页
This study describes the development and validation of a sensitive and reliable method for determination of polybrominated diphenyl ethers(PBDEs)in atmospheric particulate matter using selective pressurized liquid e... This study describes the development and validation of a sensitive and reliable method for determination of polybrominated diphenyl ethers(PBDEs)in atmospheric particulate matter using selective pressurized liquid extraction(SPLE)and gas chromatography–mass spectrometry with a negative chemical ionization(GC-NCI-MS).Extraction and clean-up were performed using PLE with 2 g florisil and 3 g silica placed in the extraction cells.Under optimal conditions,14 PBDEs were extracted at 70℃ using hexane/dichloromethane(50:50,v/v)as solvent.Validation of SPLE returned excellent recoveries for most analytes,with relative standard deviations mostly below20%.Method detection limits ranged from 0.13 to15.38 ng·mL^-1 for the GC-MS analyses.The method was successfully applied to atmospheric particulate matter of Beijing,where analytes were detected in the range of182.79 to 468.99 pg·m^-3. 展开更多
关键词 Brominated diphenyl ethers Atmospheric particulate matters Selective pressurised liquid extraction Gas chromatography-mass spectrometry
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Identification of the metabolites of polybrominated diphenyl ether 99 and its related cytochrome P450s 被引量:3
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作者 Huibin Dong Ziyin Li Xiaoming Man Jingping Zhou Huiyuan Lu Shoulin Wang 《The Journal of Biomedical Research》 CAS 2010年第3期223-232,共10页
Objective:To investigate the metabolites of polybrominated diphenyl ether 99(BDE-99)and its related cytochrome P450s in an in vitro system.Methods:Rat primary hepatocytes were isolated and treated with BDE-99 for ... Objective:To investigate the metabolites of polybrominated diphenyl ether 99(BDE-99)and its related cytochrome P450s in an in vitro system.Methods:Rat primary hepatocytes were isolated and treated with BDE-99 for 24-72 h.Metabolites were then extracted from the hepatocytes and media,and detected by GC/MS.Several mRNAs of metabolic enzymes were also extracted from the same cells and the gene expression levels were determined using quantitative real-time PCR.In addition,selected recombinant cytochrome P450s(CYPs) were expressed in a bacurovirus/sf9 system,and these were further used to explore the metabolism of BDE-99 in vitro.The parent depletion approach was used for screening the ability of CYPs to eliminate BDE-99.Results: A reductively debrominated metabolite,BDE-47,and three oxidative metabolites,2,4,5-tribromophenol,5-OH-BDE-47,and 5'-OH-BDE-99,were identified from the BDE-99-treated rat hepatocytes,whereas no MeO metabolite was detected in the system.RT-PCR analysis showed that CYP 3A23/3A1,1A2,and 2B1/2 were induced by BDE-99.Furthermore,using the heterological expressed CYP proteins in in vitro BDE-99 metabolism experiments we found that CYP1A2 and CYP3A4 showed the highest metabolic efficiency for BDE-99,with the metabolic clearance rates of CYP1A2 and CYP3A4 being 30.3%and 27.7%,respectively.CYP1A1 and CYP2A6 displayed relatively low clearance rates,while CYP2E1 seemed not to be associated with the BDE-99 metabolism.Conclusions:In our in vitro rat primary hepatocyte metabolism system,four metabolites of BDE-99 were identified,and CYP3A4 and CYP1A2 were demonstrated to be involved in the BDE-99 metabolism. 展开更多
关键词 polybrominated diphenyl ethers HEPATOCYTES cytochroem P450s METABOLITE OH-PBDEs.
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Analysis of Air Voids Evolution in Cement Pastes Admixed with Non-ionic Cellulose Ethers 被引量:3
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作者 欧志华 XIAO Yi +3 位作者 王菁菁 MA Baoguo JIANG Longmin JIAN Shouwei 《Journal of Wuhan University of Technology(Materials Science)》 SCIE EI CAS 2018年第4期915-923,共9页
Four cellulose ethers(CEs) were compared for their effects on the pore structure of cement paste using mercury intrusion porosimetry. The experimental results show that the total pore volume and porosity of cement p... Four cellulose ethers(CEs) were compared for their effects on the pore structure of cement paste using mercury intrusion porosimetry. The experimental results show that the total pore volume and porosity of cement pastes containing the four cellulose ethers are significantly higher than that of the pure cement pastes and the total pore volume and porosity of cement pastes containing HEC(hydroxyethyl cellulose ether) or low viscosity cellulose ethers are low in four CEs. By changing the surface tension and viscosity of liquid phase and the strengthening of liquid film between air voids in cement pastes, CEs affect the formation, diameter evolution and upward movement of air voids and the pore structure of hardening cement paste. For the four CEs, the pore volume of cement pastes containing HEC or low viscosity cellulose ethers is higher with the diameter of 30-70 nm while lower with the diameter larger than 70 nm. CEs affect the pore structure of cement paste mainly through their effects on the evolvement of the small air voids into bigger ones when the pore diameter is below 70 nm and their effects on the entrainment and stabilization of air voids when the pore diameter is above 70 nm. 展开更多
关键词 cellulose ethers cement pastes pore structure air voids diameter evolution
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Efficient and green tetrahydropyranylation and deprotection of alcohols and phenols by using activated carbon supported sulfuric acid 被引量:2
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作者 Jin Hui Yang Xuan Zhang Wan Yi Liu 《Chinese Chemical Letters》 SCIE CAS CSCD 2008年第8期893-896,共4页
A simple, green and efficient method for the DHP protection of various alcohols and phenols and the subsequent removal of the corresponding protective group in the presence of a catalytic amount of the activated carbo... A simple, green and efficient method for the DHP protection of various alcohols and phenols and the subsequent removal of the corresponding protective group in the presence of a catalytic amount of the activated carbon supported H2SO4 is described. 展开更多
关键词 TETRAHYDROPYRANYLATION DEPROTECTION THP ethers Activated carbon
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Gastrodin Derivatives from Gastrodia elata 被引量:4
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作者 Cheng-Bo Xu Qing-Lan Guo +3 位作者 Ya-Nan Wang Sheng Lin Cheng-Gen Zhu Jian-Gong Shi 《Natural Products and Bioprospecting》 CAS 2019年第6期393-404,共12页
Nine new gastrodin derivatives,including seven p-hydroxybenzyl-modified gastrodin ethers(1-7),6′-O-acetylgastrodin(8),and 4-[α-d-glucopyranosyl-(1→6)-β-d-glucopyranosyloxy]benzyl alcohol(9),together with seven kno... Nine new gastrodin derivatives,including seven p-hydroxybenzyl-modified gastrodin ethers(1-7),6′-O-acetylgastrodin(8),and 4-[α-d-glucopyranosyl-(1→6)-β-d-glucopyranosyloxy]benzyl alcohol(9),together with seven known derivatives,were isolated from an aqueous extract of Gastrodia elata(“tian ma”)rhizomes.Their structures were determined by spectroscopic and chemical methods as well as single crystal X-ray diffraction.Compounds 1-4,7,10,and 11 were also isolated from a reaction mixture by refluxing gastrodin and p-hydroxybenzyl alcohol in H2O.As both gastrodin and p-hydroxybenzyl alcohol exist in the plant,the reaction results provide evidence for the production and increase/decrease of potential effective/toxic components when“tian ma”is decocted solely or together with ingredients in Chinese traditional medicine formulations,though the isolates were inactive in the preliminarily cell-based assays at concentrations of 10μM.Moreover,using ultra-performance liquid chromatography high-resolution electrospray ionization mass spectrometry(UPLC-HRESIMS),4,7,10,and 11,as well as component variations,were detectable in the freshly prepared extracts of different types of samples,including the freeze-dried fresh G.elata rhizomes. 展开更多
关键词 ORCHIDACEAE Gastrodia elata Blume p-Hydroxybenzyl gastrodin ethers Reaction of gastrodin with p-hydroxybenzyl alcohol Component variation during decocting
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A Convenient and Efficient Procedure for Oxime Ethers 被引量:2
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作者 ChunBaoLI MichaelC.K.CHOI 《Chinese Chemical Letters》 SCIE CAS CSCD 2002年第2期95-96,共2页
Acetophenone oxime and benzaldehyde oxime were converted to oxime ethers in the presence of alkyl halide or methyl sulfate and KOH in aqueous DMSO in 5 to 70 min. The yields of oxime ethers were 70 - 96%.
关键词 Oxime ethers synthesis.
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Predicting the Relative Retention Time (RRT) of Polybrominated Diphenyl Ethers (PBDEs) 被引量:2
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作者 Shu Shen LIU Yan LIU +1 位作者 Da Qiang YIN Lian Sheng WANG 《Chinese Chemical Letters》 SCIE CAS CSCD 2005年第11期1559-1562,共4页
Using the molecular electronegativity distance vector descriptors derived directly from the molecular topological structures, the relative retention time (RRT) of polybrominated diphenyl ethers (PBDEs) were predic... Using the molecular electronegativity distance vector descriptors derived directly from the molecular topological structures, the relative retention time (RRT) of polybrominated diphenyl ethers (PBDEs) were predicted. A four-variable regression model (M30) with the correlation coefficient of 0.9816 and the root mean square errors of 0.061 was developed using a training set including 30 PBDEs. The correlation coefficient of 0.9841 and the root mean square errors of 0.054 between the values of RRT predicted by M30 and the RRT observed for 16 external PBDEs show a good predictive potential of M30. The descriptors included in the M30 represent four interactions between four pairs of atom types, i.e., atom -C= and -C=, -C= and 〉C=, 〉C= and 〉C=, -C= and -Br. 展开更多
关键词 Polybrominated diphenyl ethers (PBDEs) relative retention time (RRT) molecular electronegativity distance vector (MEDV).
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