13C NMR Spectroscopy
The chemical shifts of sp3-hybridized carbon atoms can be estimated with the help of an additivity rule using the shift value of methane (-2.3 ppm) and increments (Z) for substituents in α, β, γ, and δ position (see next pages). Some substituents occupy t
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NMR MS UV/Vis IR
Structure Determination of Organic Compounds Tables of Spectral Data Fifth Edition
Structure Determination of Organic Compounds
Ernö Pretsch • Philippe Bühlmann Martin Badertscher
Structure Determination of Organic Compounds Tables of Spectral Data Fifth Edition
Ernö Pretsch Institute of Biogeochemistry and Pollutant Dynamics ETH Zurich Zürich, Switzerland
Philippe Bühlmann Department of Chemistry University of Minnesota Minneapolis, MN, USA
Martin Badertscher Laboratory of Organic Chemistry ETH Zurich Zürich, Switzerland
Translation from the German language edition: Spektroskopische Daten zur Strukturaufklärung organischer Verbindungen by Ernö Pretsch, Philippe Bühlmann, Martin Badertscher Copyright © Springer-Verlag GmbH Deutschland, ein Teil von Springer Nature 1976, 1981, 1986, 2001, 2010, 2020. Published by Springer Spektrum. All Rights Reserved. ISBN 978-3-662-62438-8 ISBN 978-3-662-62439-5 (eBook) https://doi.org/10.1007/978-3-662-62439-5 © Springer-Verlag GmbH Germany, part of Springer Nature 2020 This work is subject to copyright. All rights are reserved by the Publisher, whether the whole or part of the material is concerned, specifically the rights of translation, reprinting, reuse of illustrations, recitation, broadcasting, reproduction on microfilms or in any other physical way, and transmission or information storage and retrieval, electronic adaptation, computer software, or by similar or dissimilar methodology now known or hereafter developed. The use of general descriptive names, registered names, trademarks, service marks, etc. in this publication does not imply, even in the absence of a specific statement, that such names are exempt from the relevant protective laws and regulations and therefore free for general use. The publisher, the authors, and the editors are safe to assume that the advice and information in this book are believed to be true and accurate at the date of publication. Neither the publisher nor the authors or the editors give a warranty, expressed or implied, with respect to the material contained herein or for any errors or omissions that may have been made. The publisher remains neutral with regard to jurisdictional claims in published maps and institutional affiliations. This Springer imprint is published by the registered company Springer-Verlag GmbH, DE part of Springer Nature. The registered company address is: Heidelberger Platz 3, 14197 Berlin, Germany
Preface
We present in this volume an updated collection of reference data and rules for the interpretation of spectra obtained with the spectroscopic methods most important to the structure elucidation of organic compounds: NMR spectroscopy (1H, 13C, 15N, 19F, 29Si, and 31P), mass spectrometry (EI-MS and ESI-MS/MS), and IR, Raman and UV/Vis spectroscopy. The basic idea is that a simultaneous application of several of these techniques is much more powerful than even the most sophisticated analysis of only one kind of spectrum. The ongoing success of our combined approach corroborates its utility
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