932 resultados para 1D and 2D NMR


Relevância:

100.00% 100.00%

Publicador:

Resumo:

The oscillatory behaviour of the Rayleigh-Marangoni-Bénard convective instability (R-M-B instability) regarding two combinations of two-layer fluid systems has been investigated theoretically and numerically. For the two-layer system of Silicone oil (10cSt) over Fluorinert (FC70), both linear instability analysis and 2D numerical simulation show that the instability of the system depends strongly on the depth ratio Hr = H1/H2 of the two-layer liquid. The oscillatory regime at the onset of R-M-B convection enlarges with reducing Γ = Ra/Ma values. In the two-layer system of Silicone oil (2cSt) over water, it loses its stability and onsets to steady convection at first, then the steady convection bifurcates to oscillatory convection with increasing Rayleigh number Ra. This behaviour was found through numerical simulation above the onset of steady convection in the case of r = 2.9, ε=(Ra-Ruc)/Rac = 1.0, and Hr = 0.5. Our findings are different from the previous study of the Rayleigh-Benard instability and show the strong effects of the thermocapillary force at the interface on the time-dependent oscillations at or after the onset of convection. We propose a secondary oscillatory instability mechanism to explain the experimental observation of Degen et al. [Phys. Rev. E, 57 (1998), 6647-6659].

Relevância:

100.00% 100.00%

Publicador:

Resumo:

The convective instabilities in two or more superposed layers heated from below were studied extensively by many scientists due to several interfacial phenomena in nature and crystal growth application. Most works of them were performed mainly on the instability behaviors induced only by buoyancy force, especially on the oscillatory behavior at onset of convection (see Gershuni et. Al.(1982), Renardy et. Al. (1985,2000), Rasenat et. Al. (1989), and Colinet et. Al.(1994)) . But the unstable situations of multi-layer liquid convection will become more complicated and interesting while considering at the same time the buoyancy effect combined with thermocapillary effect. This is the case in the gravity reduced field or thin liquid layer where the thermocapillary effect is as important as buoyancy effect. The objective of this study was to investigate theoretically the interaction between Rayleigh-Bénard instability and pure Marangoni instability in a two-layer system, and more attention focus on the oscillatory instability both at the onset of convection and with increasing supercriticality. Oscillatory behavious of Rayleigh-Marangoni-Bénard convective instability (R-M-B instability) and flow patterns are presented in the two-layer system of Silicon Oil (10cSt) over Fluorinert (FC70) for a larger various range of two-layer depth ratios (Hr=Hupper/Hdown) from 0.2 to 5.0. Both linear instability analysis and 2D numerical simulation (A=L/H=10) show that the instability of the system depends strongly on the depth ratio of two-layer liquids. The oscillatory instability regime at the onset of R-M-B convection are found theoretically in different regions of layer thickness ratio for different two-layer depth H=12,6,4,3mm. The neutral stability curve of the system displaces to right while we consider the Marangoni effect at the interface in comparison with the Rayleigh-Bénard instability of the system without the Marangoni effect (Ma=0). The numerical results show different regimes of the developing of convection in the two-layer system for different thickness ratios and some differences at the onset of pure Marangoni convection and the onset of Rayleigh-Bénard convections in two-layer liquids. Both traveling wave and standing wave were detected in the oscillatory instability regime due to the competition between Rayleigh-Bénard instability and Marangoni effect. The mechanism of the standing wave formation in the system is presented numerically in this paper. The oscillating standing wave results in the competition of the intermediate Marangoni cell and the Rayleigh convective rolls. In the two-layer system of 47v2 silicone oil over water, a transition form the steady instability to the oscillatory instability of the Rayleigh-Marangoni-Bénard Convection was found numerically above the onset of convection for ε=0.9 and Hr=0.5. We propose that this oscillatory mechanism is possible to explain the experimental observation of Degen et. Al.(1998). Experimental work in comparison with our theoretical findings on the two-layer Rayleigh-Marangoni-Bénard convection with thinner depth for H<6mm will be carried out in the near future, and more attention will be paid to new oscillatory instability regimes possible in the influence of thermocapillary effects on the competition of two-layer liquids

Relevância:

100.00% 100.00%

Publicador:

Resumo:

The Rayleigh-Marangoni-Benard convective instability (R-M-B instability) and flow patterns in the two-layer system of silicon oil 10cSt and Fluorinert FC70 liquids are studied theoretically and experimentally. Both linear instability analysis and 2D numerical simulation (A=L/H=10) were performed to study the influence of thermocapillary force on the convective instability of the two-layer system. Time-dependent oscillations arising at the onset of convection were investigated in a larger various range of two-layer depth ratios (Hr=H1/H2) from 0.2 to 5.0 for different total depth less than 12mm. Our results are different from the previous study on the Rayleig-B閚ard instability and show the strong effects of thermocapillary force at the interface on the time-dependent oscillations at the onset of instability convection. Primary experimental results of the critical instability parameters and the convective structure in the R-M-B convection have been obtained by using the digital particle image velocimetry (DPIV) system, and a good agreement in comparison with the results of numerical simulation was obtained.

Relevância:

100.00% 100.00%

Publicador:

Resumo:

A new high-order finite volume method based on local reconstruction is presented in this paper. The method, so-called the multi-moment constrained finite volume (MCV) method, uses the point values defined within single cell at equally spaced points as the model variables (or unknowns). The time evolution equations used to update the unknowns are derived from a set of constraint conditions imposed on multi kinds of moments, i.e. the cell-averaged value and the point-wise value of the state variable and its derivatives. The finite volume constraint on the cell-average guarantees the numerical conservativeness of the method. Most constraint conditions are imposed on the cell boundaries, where the numerical flux and its derivatives are solved as general Riemann problems. A multi-moment constrained Lagrange interpolation reconstruction for the demanded order of accuracy is constructed over single cell and converts the evolution equations of the moments to those of the unknowns. The presented method provides a general framework to construct efficient schemes of high orders. The basic formulations for hyperbolic conservation laws in 1- and 2D structured grids are detailed with the numerical results of widely used benchmark tests. (C) 2009 Elsevier Inc. All rights reserved.

Relevância:

100.00% 100.00%

Publicador:

Resumo:

A Bacia de Almada, localizada no estado da Bahia, compartilha características similares com as outras bacias da margem leste do Brasil, quando é analisada segundo aspectos como os processos sedimentares e o regime de esforço dominante durante a sua formação. Observa-se uma diferença marcante em relação as outras bacias quando é analisada sob a ótica da composição da crosta transicional, uma vez que não se registra atividade vulcânica durante a fase rifte. A aquisição de um extenso levantamento sísmico 3D, com cabos de 6 km de comprimento e 9.2 segundos de tempo de registro (tempo sísmico duplo), resultaram em imagens sísmicas de boa qualidade das estruturas profundas do rifte. Adicionalmente, estudos de modelagem gravimétrica foram integrados com a análise sísmica para corroborar o modelo geológico. A Bacia de Almada é parte dos sistemas de rifte continentais, desenvolvidos durante o Berriasiano até o Aptiano, que antecederam a quebra do continente do Gondwana, evoluindo posteriormente para uma margem passiva divergente. O processo do rifteamento desenvolveu cinco sub-bacias de orientação NNE-SSO, desde posições terrestres até marinhas profundas, produzindo um arcabouço estrutural complexo. Os perfis da sísmica profunda mostram o afinamento progressivo da crosta continental até espessuras da ordem de 5 km, abaixo da sub-bacia mais oriental, com fatores de estiramento crustal próximo a 7 antes do desenvolvimento de crosta oceânica propriamente dita. As imagens sísmicas de boa qualidade permitem também o reconhecimento de sistemas de falhas lístricas que se iniciam na crosta superior, evoluem atravessando a crosta e conectando as sub-bacias para finalizar em um descolamento horizontal na crosta inferior estratificada. Adicionalmente, a bacia apresenta um perfil assimétrico, compatível com mecanismos de cisalhamento simples. As margens vulcânicas (VM) e não vulcânicas (NVM), são os extremos da análise composicional das margens divergentes continentais. Na Bacia de Almada não se reconhecem os elementos arquiteturais típicos das VM, tais como são as grandes províncias ígneas, caracterizadas por cunhas de refletores que mergulham em direção ao mar e por intenso vulcanismo pré- e sin-rifte nas bacias. Embora a margem divergente do Atlântico Sul seja interpretada tradicionalmente como vulcânica, o segmento do rifte ao sul do Estado da Bahia apresenta características não-vulcânicas, devido à ausência destes elementos arquiteturais e aos resultados obtidos nas perfurações geológicas que eventualmente alcançam a seqüência rifte e embasamento. Regionalmente a margem divergente sul-americana é majoritariamente vulcânica, embora a abundância e a influência do magmatísmo contemporâneo ao rifte seja muito variável. Ao longo da margem continental, desde a Bacia Austral no sul da Argentina, até a Bacia de Pernambuco no nordeste do Brasil, podem ser reconhecidos segmentos de caráter vulcânico forte, médio e não vulcânico. Nos exemplos clássicos de margens não vulcânicas, como a margem da Ibéria, a crosta transicional é altamente afinada podendo apresentar evidências de exumação de manto. Na Bacia de Almada, a crosta transicional apresenta importante estiramento embora não haja evidências concretas de exumação de manto. Os mecanismos responsáveis pela geração e intrusão dos grandes volumes de magma registrados nas margens divergentes são ainda sujeitos a intenso debate. Ao longo da margem divergente sul-americana há evidências da presença dos mecanismos genéticos de estiramento litosférico e impacto de plumas. Alternativamente estes dois mecanismos parecem ter tido um papel importante na evolução tectônica da margem sudeste e sul, diferenciando-as da margem continental onde foi implantada a Bacia de Almada.

Relevância:

100.00% 100.00%

Publicador:

Resumo:

Nesta dissertação foram avaliadas metodologias para reação de amidação de amostras comerciais de poli (metilmetacrilato), PMMA, com alilamina e benzilamina. A reação foi executada em tubo selado sob aquecimento a 90 C por sete dias, sem que nenhuma quantidade mensurável de amida pudesse ser detectada por FTIR e RMN. A reação foi reavaliada sob catalise de DBU, 3,4% molar, sem que nenhum resultado positivo obtido. O emprego de DBU associado ao NaCN como co-catalisador mostrou-se eficaz é o PMMA pode ser derivatizado em 30 %, com alilamina, e 13 % com benzilamina, sob as mesmas condições de temperatura e tempo. A analise elementar e o RMN-1H foram conclusivos na quantificação das reações enquanto o FTIR mostrou-se pouco eficaz devido a sobreposições de bandas. A taticidade das amostras comerciais de PMMA e do material produzido pode ser avaliada por RMN. Experimentos exploratórios efetuados em forno de microondas monomodo sob as mesmas relações molares com aquecimento a 120 C por 30 minutos com 80 W de potencia não foram capazes de promover alterações na matriz polimérica

Relevância:

100.00% 100.00%

Publicador:

Resumo:

We determine the Raman scattering efficiency of the G and 2D peaks in graphene. Three substrates are used: silicon covered with 300 or 90 nm oxide, and calcium fluoride (CaF2). On Si/SiOx, the areas of the G and 2D peak show a strong dependence on the substrate due to interference effects, while on CaF2 no significant dependence is detected. Unintentional doping is reduced by placing graphene on CaF2. We determine the Raman scattering efficiency by comparison with the 322 cm -1 peak area of CaF2. At 2.41 eV, the Raman efficiency of the G peak is ∼200×10-5 m-1Sr-1, and changes with the excitation energy to the power of 4. The 2D Raman efficiency is at least one order of magnitude higher than that of the G peak, with a different excitation energy dependence. © 2013 American Physical Society.

Relevância:

100.00% 100.00%

Publicador:

Resumo:

Rashba spin splitting is a two-dimensional (2D) relativistic effect closely related to spintronics. However, so far there is no pristine 2D material to exhibit enough Rashba splitting for the fabrication of ultrathin spintronic devices, such as spin field effect transistors (SFET). On the basis of first-principles calculations, we predict that the stable 2D LaOBiS2 with only 1 nm of thickness can produce remarkable Rashba spin splitting with a magnitude of 100 meV. Because the medium La2O2 layer produces a strong polar field and acts as a blocking barrier, two counter-helical Rashba spin polarizations are localized at different BiS 2 layers. The Rashba parameter can be effectively tuned by the intrinsic strain, while the bandgap and the helical direction of spin states sensitively depends on the external electric field. We propose an advanced Datta-Das SFET model that consists of dual gates and 2D LaOBiS2 channels by selecting different Rashba states to achieve the on-off switch via electric fields. © 2013 American Chemical Society.

Relevância:

100.00% 100.00%

Publicador:

Resumo:

Effects of structure parameters on bend loss of rib silicon-on-insulator (Sol) bend waveguides have been analyzed by means of effective index method (EIM) and 2D bend loss formula. The simulation results indicate that the bend loss decreases with the increase of bend radius and waveguide width, as well as with the decrease of the step factor of the rib waveguide. Moreover, the optional structure parameters have been found when bend waveguides are single-mode.

Relevância:

100.00% 100.00%

Publicador:

Resumo:

This paper presents a novel CMOS color pixel with a 2D metal-grating structure for real-time vision chips. It consists of an N-well/P-substrate diode without salicide and 2D metal-grating layers on the diode. The periods of the 2D metal structure are controlled to realize color filtering. We implemented sixteen kinds of the pixels with the different metal-grating structures in a standard 0.18 mu m CMOS process. The measured results demonstrate that the N-well/P-substrate diode without salicide and with the 2D metal-grating structures can serve as the high speed RGB color active pixel sensor for real-time vision chips well.

Relevância:

100.00% 100.00%

Publicador:

Resumo:

Tunable biaxial stresses, both tensile and compressive, are applied to a single layer graphene by utilizing piezoelectric actuators. The Gruneisen parameters for the phonons responsible for the D, G, 2D and 2D' peaks are studied. The results show that the D peak is composed of two peaks, unambiguously revealing that the 2D peak frequency (omega(2D)) is not exactly twice that of the D peak (omega(D)). This finding is confirmed by varying the biaxial strain of the graphene, from which we observe that the shift of omega(2D)/2 and omega(D) are different. The employed technique allows a detailed study of the interplay between the graphene geometrical structures and its electronic properties.

Relevância:

100.00% 100.00%

Publicador:

Resumo:

本文建立了一个能用于含N、P、O、S、Si及卤素等多种杂原子的有机化合物结构自动解析专家系统ESESOC(Expert System for the Elucidation of the Structure of Orsanic Compounds)。它可从未知化合物的分子式、光谱数据(包括IR, MS,~1HNMK ~(13)CNMR, 2D-NMR等)及其它化学信息自动地推衍出与己知信息相一致的候选化合物结构。ESESOC系统由三个部分组成:(1)光谱知识库及其光谱解释模块;(2)结构产生器;(3)结构验证模块。其结构解析基本过程为:从分子式、光谱数据或其它化学信息出发,由未知化合物的光谱数据去检索光谱知识库,即进行数据分析并推断出该未知化合物中可能含有的结构碎片,然后由结构产生器从这些结构碎片进行候选化合物结构的穷举生成,最后对候选结构进行验证并输出结果。从而实现由化合物光谱数据鉴别未知化合物结构的自动化。结构产生器是系统的核心模块。对一个结构产生器的基本要求是:穷举性,非冗余性,有效性。要完成一个能实际使用的结构产生器,效率则是至关重要的。ESESOC系统生成结果的穷举和非冗余性己通过与图论计算结果及著名的DENDRAL系统的生成结果相比较得以证明。如由本系统生成的烷烃系列C_nH_(2n+2),及醇、醚系列C_nH_(2n+2)0的异构体数目与图论理论计算的数目相同;对C_5H_n n = 12,10,8,6,4,2,O;C_6H_n n = 14,12,lO,8,6,4,2,O系列,及含多种杂原子(O、N、S等)的复杂体系,其异构体生成结果则与DENDRAL系统的生成结果完全一致(DENDRAL系统的结构生成算法是经数学证明了是正确的,其结果已被很多系统引为穷举和非冗余性的例证)。关于ESESOC系统的有效性,在同一计算机上测试结果表明ESESOC系统的结构生成效率比著名的日本的CHEMICS系统高很多倍。结构解析专家系统另一重要组成部分为谱图知识库,它是逻辑推理的基础。专家系统的效能取决于其子结构一子光谱相关的知识库的有效性,所以要建造一个有效的~(13)CNMR知识库,关键在于建立一个好的子结构模型.在~(13)CNMR知识库中,子结构的概念与常规的子结构概念有所不同,它包括两个组成部分,(1)中心原子,它对应于一个化学位移;(2)环境部分,结构环境决定了中心原子的化学位移峰的位置。子结构模型的选择要适当兼顾信息全面和防止“组合爆炸”两个因素。ESESOC系统从~(13)CNMR本身的特征出发,提出了不确定层数的子结构模型。即以共振碳原子为中心,以与之相连的完整的官能团为外围环境,对这样的子结构,其外围环境根据官能团的不同可以是一层、或二层乃至多层,即环境层数是可变的。此即为ESESOC系统的广义-层子结构模型,它具有包含结构信息全,所有可能存在的子结构数量适中等优点。在此子结构模型的基础上,从CIAC-~(13)CNMR谱图数据库统计出。~(13)CNMR知识库,即子结构-~(13)CNMR化学位移相关表。ESESOC系统中结构验证方法有: ~(13)CNMR谱峰数预测,~(13)CNMR波谱模拟,应力能计算等。在结构解析专家系统研究中还涉及到如下三个问题:(1)结构编码;(2)结构之间相互比较;(3)结构中原子的对称性分析。在本研究中,对这些问题都提出了新的方案,并均获得较好结果。(1)在建造化合物结构信息系统时,首先要解决化合物结构的计算描述,即结构编码问题,以进行化合物结构的计算机存储和管理。为此我们提出了两种新的拓扑指数编码方案,即ID指数和EAID指数。由ESESOC结构产生器穷生成了含1-22个碳原子的380多万个链烷烃异构体,含1-12四价碳原子的20多万仑复杂多环异构体及40多万个含杂原子的化合物,通过对这3个系列共440多万个化合物结构的验证,结果表明,ID和EAID指数对这440多万个化合物结构均能唯一地区分,即没有出现简并(简并是指两个或多个不同的结构具有相同的拓扑指数值)。这是迄今未见报道的。(2)在计算机结构信息处理中,最常遇到的一个问题就是确认一个结构是新结构还是为已知结构,这就要把该结构与库中的结构进行逐个比较。为了结构的比较,我们以二维连接表描述化合物的结构,因连接表随化合中原子的编序的变化而变化,因而就需要有一套序号赋值规则,无论结构图在画法或形状以及原子的序号上如何变化,都可使得结构图中的各原子按该规则得到唯一的排序方案。ESESOC系统的唯一性序号方案集中了Morgan算法及其改进方案之所长,并加入新的图的不变量,如最小环指数等以正确地划分分子中的原子,从而得到一个新的唯一性排序方案,该方案效率较高,可适用于各类复杂化合物。在ESESOC系统中,我们还以一维的整数数组来存贮和管理二维连接表,即得到压缩连接表,这在结构比较时大大地节省了系统开销,提高了比较速度。在同一结构中,若各原子由两种不同编序方案得到同一连接矩阵,则与某一序号所对应的两个原子所在结构图中的拓扑环境是等价的,也就是说两个节点是拓扑等价的,或具有拓扑对称性(Topological Symmetry)。化合物结构中原子的唯一性排序算法,有机化物结构异构体穷举生成过程中冗余对接的消除,NMR谱模拟等都与拓扑对称性密切相关。在ESESOC系统建造过程中,我们提出了三个新的拓扑等价性分析算法,它们是基于节点矩阵的拓扑等价性算法,基于全通道算法的拓扑等价性算法,以及基于扩展连接矩阵算法的拓扑等价性算法。这些算法结果准确,效率高,适用于各类化合物。

Relevância:

100.00% 100.00%

Publicador:

Resumo:

Two obvious emissions are observed from the ZnS clusters encapsulated in zeolite-Y. The emission around 355 nm is sharp and weak, locating at the onset of the absorption edge. The band around 535 nm is broad, strong and Stokes-shifted. Both the two emissions shift to blue and their intensities firstly increase then decrease as the loading of ZnS in zeolite-Y or clusters size decreases. Through investigation, the former is attributed to the excitonic fluorescence, and the latter to the trapped luminescence from surface states. The cluster size-dependence of the luminescence may be explained qualitatively by considering both the carrier recombination and the nonradiative recombination rates. Four peaks appearing in the excitation spectra are assigned to the transitions of 1S-1S, 1S-1P, 1S-1D and surface state, respectively. The excitation spectra of the clusters do not coincide with their absorption spectra. The states splitted by quantum-size confinement are detected in the excitation spectra, but could not be differentiated in the optical absorption spectra due to inhomogeneous broadening. The size-dependence of the excitation spectra is similar to that of the absorption spectra. Both the excitation spectra of excitonic and of trapped emissions are similar, but change in relative intensity and shift in position are observed.

Relevância:

100.00% 100.00%

Publicador:

Resumo:

With contributions from both three-dimensional (3D) electrons in heavily doped contacts and 2D electrons in the accumulation layer, a self-consistent calculation based on effective mass theory is presented for studying the anomalous behaviour of the quasi-bound levels in the accumulation layer and that in the central well of an asymmetric double barrier structure (DBS). By choosing the thickness of the incident barrier properly, it is revealed that these two quasi-bound levels may merge into a unique bound level in the off-resonance regime which shows a very good 2D nature in contrast to the conventional picture for level crossing. An evident intrinsic I-V bistability is also shown. It is noticeable that the effect of charge build-up in the central well is so strong that the electric field in the incident barrier even decreases when the applied bias increases within the resonant region.

Relevância:

100.00% 100.00%

Publicador:

Resumo:

本论文由三个部分组成。第一部分是综述性文章-天然C19-二萜生物碱的结构及其核磁共振波谱。这篇综述参考160余篇文献,将迄今为止发表的230余个天然C19-二萜生物碱按其结构和波谱特征,分为10个类型。重点叙述了每个类型的结构和核磁共振波谱,对一些立体构型与13C-NMR化学位移的关系进行了讨论。最后以表格的形式报导了每个天然C19-二萜生物碱的结构及其植物来源,并把其中170余个收集到的13C-NMR化学位移数据整理成表,作为手册,对鉴定此类化合物大有帮助。第二部分是实验论文--弯啄乌头的化学成分研究。重点报导了弯啄乌头(Aconitum campylorrhynchun Hand-Nazz.)中分离到的一个新生物碱--8-乙酰都啦碱(8-acetyldolaconine)的结构鉴定,并根据DEPT、COSY、COLO等对1H-NMR和13C-NMR的所有信号归属都进行了指定。通过各种图谱还发现这个生物碱的A环同时存在着椅式和船式两种构象导购体。另外还报导了从同一植物的生物碱部分分离到的两个二萜生物碱,它们都是嘟啦碱和aconosine.在非生物碱部分还分离到三个化合物,经鉴定证明是β-谷甾醇、棕榈酸和香豆酸。第三部分也是实验论文--展毛翠雀花中生物碱成分的研究。报导了从展毛翠雀花(Delphinium Kamaonense Var.glabrescens W. T. Wang)中初步分离到的两个生物碱。经IR、NS、1H-NMR和13C-NMR等方法确定结构,证明其中一个是新化合物,命名为展毛翠雀碱(glabredelphinine)。另外一个是前几年发现的二萜生物碱tatsiensine。这两个化合物的A环上都有碳-碳不饱和键,这在天然C19-二萜生物碱中还比较少见。This master's thesis consists of three parts. The first part is a review: The relationship between the chemical structures of natural C19-diterpene alkaloids and their NMR chemical shift data. The C19-diterpene alkaloids were divided into ten types according to their structures and NMR data. Some relationaships between configuration and NMR chemical shift have been discussed. The structures and distributions of more than 230 known C19-diterpene alkaloids and the assignments of 13C-NMR data of the 170 alkaloids of them were listed in tables. The second part is an experimental paper, Studies on the chemical constituents of Aconitum campylorrhynchum. Six compounds were isolated from the roots of title plant. One of them is a new alkaloid. It has been elucidaled as 8-acetyldolaconine by means of IR, MS, 1H-NMR,13C-NMR,DEPT,COSY,COLOC and on the basis of identification with aconosine by saponification. Other five compounds were idenfified as dolaconine, aconosine,β-sitosterol, palmitic acid and p-coumaric acid. The third part is also experimental paper: The alkaloids of Delphinium Kamaonense var.glabrescens. Two alkaloids were isolated from the roots of title plant. One of them, C22H22O6N,m.p.201-3℃,named glabredelphinine, was proved to be a new compound. Its structure has been established as 2(3)-dehydro-6-demethyl-18-delcosine by means of IR, MS, 1H-NMR and 13C-NMR.The other one was identified as tatsiensine by comparising of IR, MS, 1H-NMR and 13C-NMR data with that from the literatute.