Structure Elucidation in Organic Chemistry

Structure Elucidation in Organic Chemistry
Author: Maria-Magdalena Cid
Publisher: John Wiley & Sons
Total Pages: 554
Release: 2015-04-20
Genre: Science
ISBN: 3527333363

Intended for advanced readers, this is a review of all relevant techniques for structure analysis in one handy volume. As such, it provides the latest knowledge on spectroscopic and related techniques for chemical structure analysis, such as NMR, optical spectroscopy, mass spectrometry and X-ray crystallography, including the scope and limitation of each method. As a result, readers not only become acquainted with the techniques, but also the advantages of the synergy between them. This enables them to choose the correct analytical method for each problem, saving both time and resources. Special emphasis is placed on NMR and its application to absolute configuration determination and the analysis of molecular interactions. Adopting a practical point of view, the author team from academia and industry guarantees both solid methodology and applications essential for structure determination, equipping experts as well as newcomers with the tools to solve any structural problem.

Structure Elucidation by Modern NMR

Structure Elucidation by Modern NMR
Author: Helmut Duddeck
Publisher: Springer Science & Business Media
Total Pages: 214
Release: 2013-04-18
Genre: Science
ISBN: 3642883109

During the last few years, routine applications of NMR (Nuclear Magnetic Resonance) techniques have developed at a tremendous pace. The latest generation of spectrometers have enabled chemists to perform new types of experiments, such as spinlock and inverse-detected methods. This third, revised and expanded edition introduces the latest methodologies and incorporates them into new exercises.

Computer–Based Structure Elucidation from Spectral Data

Computer–Based Structure Elucidation from Spectral Data
Author: Mikhail E. Elyashberg
Publisher: Springer
Total Pages: 458
Release: 2015-02-27
Genre: Science
ISBN: 3662464020

Here, the authors introduce readers to solving molecular structure elucidation problems using the expert system ACD/Structure Elucidator. They explain in detail the concepts of the Computer-Assisted Structure Elucidation (CASE) approach and point out the crucial role of understanding the axiomatic nature of the data used to deduce the structure. Aspects covered include the main blocks of the expert system and essential features of the mathematical algorithms used. Graduate and PhD students as well as practicing chemists are provided with a detailed explanation of the various practical approaches depending on available spectral data peculiarities and the complexity of the unknown structure. This is supported by a large number of real-world completed examples, most of which are related to the structure elucidation of natural product molecules containing unusual skeletons. Dedicated software and further supplementary material are available at www.acdlabs.com/TeachingSE.

Aspects of Organic Chemistry

Aspects of Organic Chemistry
Author: Gerhard Quinkert
Publisher: John Wiley & Sons
Total Pages: 530
Release: 1996
Genre: Chemical structure
ISBN: 9783906390154

Modeling molecular structures is a useful tool for the description, classification and understanding of molecules – species, which have already been synthesized, and others existing only in the imagination of the chemist. The first part of the four–volume series ′Aspects of Organic Chemistry′ focuses on molecular structure, especially that of nucleid acids and proteins. The authors, a team of internationally recognized specialists, present a modern interdisciplinary concept between chemistry – and biology – an approach, which proved to be useful in university education. A unique book, important for both lecturers and students. Subjects of the three remaining volumes are ′Reactivity′, ′Synthesis′ and ′Methods of Structure Elucidation′.

Structure Elucidation by Modern NMR

Structure Elucidation by Modern NMR
Author: H. Duddeck
Publisher: Springer Science & Business Media
Total Pages: 236
Release: 2012-12-06
Genre: Science
ISBN: 3642977812

For several years we have been organizing seminars and workshops on the application of modem one and two-dimensional NMR methods at the faculty of chemistry in the Ruhr-University Bochum, FRG, and elsewhere, addressing researchers and graduate students who work in the field of organic and natural products chemistry. In 1987, we wrote a workbook (StrukturaufkUirung mit modemer NMR-Spektroskopie, Steinkopff, Darmstadt, FRG, 1988) in German language based on our experience in these courses. Many of the exercises described therein have been used in such courses and some of them have been shaped by the participants to a great extent. The response of readers and discussions with colleagues from many countries encouraged us to produce an English translation in order to make the book accessible to a wider audience. Moreover, the content has been increased from 20 exercise examples in the German, to 23 in the English version. This book could not have been written in the present form without the help of a number of col leagues and, therefore, we acknowledge gratefully the generous supply of samples from and useful discussions with B. Abegaz (Addis Ababa, Ethiopia), U.H. Brinker (Bingham, New York, USA), E.