Structure Determination of Organic Compounds Tables of Spectral Data

ISBN-10: 3540938095

ISBN-13: 9783540938095

Edition: 4th 2009

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Description: This fourth edition of the highly successful and concise textbook contains about 20 % new data. Now included are chapters on 19F and 31P NMR as well as references to important Raman bands. With their unique approach of presenting - in the form of texts, tables, charts, and graphs - a succinct compilation of essential reference data for the interpretation of NMR, IR, UV/Vis, and mass spectra, the authors also provide a hands-on guide for interpreting experimental spectral data and elucidating the structure of the respective compounds behind them.Besides spectra of common solvents, calibration reagents, and MALDI and FAB MS matrix materials, fragmentation rules for mass spectrometry and UV/Vis spectra of representative compounds are included. The book will benefit students during courses and exercises, and advanced learners may use it to supplement their understanding of extended textbooks on the topic. While only a basic knowledge of spectroscopic techniques is required to use this book, it will serve as a data reference for specialists in the field and will support practitioners routinely faced with the task of interpreting spectral information.From a review of the previous edition:"Practically all teachers in spectroscopy and countless students know these books and work continuously with them." (Magnetic Resonance in Chemistry, 2002, Vol. 40, Issue 3, p. 247)

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Book details

Edition: 4th
Copyright year: 2009
Publisher: Springer London, Limited
Publication date: 3/19/2009
Binding: Paperback
Pages: 433
Size: 6.00" wide x 9.25" long x 1.00" tall
Weight: 1.738
Language: English

Introduction
Scope and Organization
Abbreviations and Symbols
Summary Tables
General Tables
Calculation of the Number of Double Bond Equivalents from the Molecular Formula
Properties of Selected Nuclei
13C NMR Spectroscopy
1H NMR Spectroscopy
IR Spectroscopy
Mass Spectrometry
Average Masses of Naturally Occurring Elements with Masses and Representative Relative Abundances of Isotopes
Ranges of Natural Isotope Abundances of Selected Elements
Isotope Patterns of Naturally Occurring Elements
Calculation of Isotope Distributions
Isotopic Abundances of Various Combinations of Chlorine, Bromine, Sulfur, and Silicon
Isotope Patterns of Combinations of Cl and Br
Indicators of the Presence of Heteroatoms
Rules for Determining the Relative Molecular Weight (Mr)
Homologous Mass Series as Indications of Structural Type
Mass Correlation Table
References
UV/Vis Spectroscopy
Combination Tables
Alkanes, Cycloalkanes
Alkenes, Cycloalkenes
Alkynes
Aromatic Hydrocarbons
Heteroaromatic Compounds
Halogen Compounds
Oxygen Compounds
Alcohols and Phenols
Ethers
Nitrogen Compounds
Amines
Nitro Compounds
Thiols and Sulfides
Carbonyl Compounds
Aldehydes
Ketones
Carboxylic Acids
Esters and Lactones
Amides and Lactams
13C NMR Spectroscopy
Alkanes
Chemical Shifts
Coupling Constants
References
Alkenes
Chemical Shifts
Coupling Constants
References
Alkynes
Chemical Shifts
Coupling Constants
References
Alicyclics
Chemical Shifts
Coupling Constants
Aromatic Hydrocarbons
Chemical Shifts
Coupling Constants
References
Heteroaromatic Compounds
Chemical Shifts
Coupling Constants
Halogen Compounds
Fluoro Compounds
Chloro Compounds
Bromo Compounds
Iodo Compounds
References
Alcohols, Ethers, and Related Compounds
Alcohols
Ethers
Nitrogen Compounds
Amines
Nitro and Nitroso Compounds
Nitrosamines and Nitramines
Azo and Azoxy Compounds
Imines and Oximes
Hydrazones and Carbodiimides
Nitriles and Isonitriles
Isocyanates, Thiocyanates, and Isothiocyanates
Sulfur Compounds
Thiols
Sulfides
Disulfides and Sulfonium Salts
Sulfoxides and Sulfones
Sulfonic and Sulfinic Acids and Derivatives
Sulfurous and Sulfuric Acid Derivatives
Sulfur-Containing Carbonyl Derivatives
Carbonyl Compounds
Aldehydes
Ketones
Carboxylic Acids
Esters and Lactones
Amides and Lactams
Miscellaneous Carbonyl Derivatives
Miscellaneous Compounds
Compounds with Group IV Elements
Phosphorus Compounds
Miscellaneous Organometallic Compounds
Natural Products
Amino Acids
Carbohydrates
Nucleotides and Nucleosides
Steroids
Spectra of Solvents and Reference Compounds
13C NMR Spectra of Common Deuterated Solvents
13C NMR Spectra of Secondary Reference Compounds
13C NMR Spectrum of a Mixture of Common Nondeuterated Solvents
1H NMR Spectroscopy
Alkanes
Chemical Shifts
Coupling Constants
Alkenes
Substituted Ethylenes
Conjugated Dienes
Allenes
Alkynes
Alicyclics
Aromatic Hydrocarbons
Heteroaromatic Compounds
Non-Condensed Heteroaromatic Rings
Condensed Heteroaromatic Rings
Halogen Compounds
Fluoro Compounds
Chloro Compounds
Bromo Compounds
Iodo Compounds
Alcohols, Ethers, and Related Compounds
Alcohols
Ethers
Nitrogen Compounds
Amines
Nitro and Nitroso Compounds
Nitrites and Nitrates
Nitrosamines, Azo and Azoxy Compounds
Imines, Oximes, Hydrazones, and Azines
Nitriles and Isonitriles
Cyanates, Isocyanates, Thiocyanates, and Isothiocyanates
Sulfur Compounds
Thiols
Sulfides
Disulfides and Sulfonium Salts
Sulfoxides and Sulfones
Sulfonic, Sulfurous, and Sulfuric Acids and Derivatives
Thiocarboxylate Derivatives
Carbonyl Compounds
Aldehydes
Ketones
Carboxylic Acids and Carboxylates
Esters and Lactones
Amides and Lactams
Miscellaneous Carbonyl Derivatives
Miscellaneous Compounds
Compounds with Group IV Elements
Phosphorus Compounds
Miscellaneous Compounds
References
Natural Products
Amino Acids
Carbohydrates
Nucleotides and Nucleosides
Spectra of Solvents and Reference Compounds
1H NMR Spectra of Common Deuterated Solvents
1H NMR Spectra of Secondary Reference Compounds
1H NMR Spectrum of a Mixture of Common Nondeuterated Solvents
Heteronuclear NMR Spectroscopy
19F NMR Spectroscopy
19F Chemical Shifts of Perfluoroalkanes
Estimation of 19F Chemical Shifts of Substituted Fluoroethylenes
Coupling Constants in Fluorinated Alkanes and Alkenes
19F Chemical Shifts of Allenes and Alkynes
19F Chemical Shifts and Coupling Constants of Fluorinated Alicyclics
19F Chemical Shifts and Coupling Constants of Aromatics and Heteroaromatics
19F Chemical Shifts of Alcohols and Ethers
19F Chemical Shifts of Fluorinated Amine, Imine, and Hydroxylamine Derivatives
19F Chemical Shifts of Sulfur Compounds
19F Chemical Shifts of Carbonyl and Thiocarbonyl Compounds
19F Chemical Shifts of Fluorinated Boron, Phosphorus, and Silicon Compounds
19F Chemical Shifts of Natural Product Analogues
References
31P NMR Spectroscopy
31P Chemical Shifts of Tricoordinated Phosphorus, PR1R2R3
31P Chemical Shifts of Tetracoordinated Phosphonium Compounds
31P Chemical Shifts of Compounds with a P=C or P=N Bond
31P Chemical Shifts of Tetracoordinated P(=O) and P(=S) Compounds
31P Chemical Shifts of Penta- and Hexacoordinated Phosphorus Compounds
31P Chemical Shifts of Natural Phosphorus Compounds
IR Spectroscopy
Alkanes
Alkenes
Monoenes
Allenes
Alkynes
Alicyclics
Aromatic Hydrocarbons
Heteroaromatic Compounds
Halogen Compounds
Fluoro Compounds
Chloro Compounds
Bromo Compounds
Iodo Compounds
Alcohols, Ethers, and Related Compounds
Alcohols and Phenols
Ethers, Acetals, and Ketals
Epoxides
Peroxides and Hydroperoxides
Nitrogen Compounds
Amines and Related Compounds
Nitro and Nitroso Compounds
Imines and Oximes
Azo, Azoxy, and Azothio Compounds
Nitriles and Isonitriles
Diazo Compounds
Cyanates and Isocyanates
Thiocyanates and Isothiocyanates
Sulfur Compounds
Thiols and Sulfides
Sulfoxides and Sulfones
Thiocarbonyl Derivatives
Thiocarbonic Acid Derivatives
Carbonyl Compounds
Aldehydes
Ketones
Carboxylic Acids
Esters and Lactones
Amides and Lactams
Acid Anhydrides
Acid Halides
Carbonic Acid Derivatives
Miscellaneous Compounds
Silicon Compounds
Phosphorus Compounds
Boron Compounds
Amino Acids
Solvents, Suspension Media, and Interferences
Infrared Spectra of Common Solvents
Infrared Spectra of Suspension Media
Interferences in Infrared Spectra
Mass Spectrometry
Alkanes
Alkenes
Alkynes
Alicyclics
Aromatic Hydrocarbons
Heteroaromatic Compounds
Halogen Compounds
Alcohols, Ethers, and Related Compounds
Alcohols and Phenols
Hydroperoxides
Ethers
Aliphatic Epoxides
Aliphatic Peroxides
References
Nitrogen Compounds
Amines
Nitro Compounds
Diazo Compounds and Azobenzenes
Azides
Nitriles and Isonitriles
Cyanates, Isocyanates, Thiocyanates, and Isothiocyanates
References
Sulfur Compounds
Thiols
Sulfides and Disulfides
Sulfoxides and Sulfones
Sulfonic Acids and Their Esters and Amides
Thiocarboxylic Acid Esters
References
Carbonyl Compounds
Aldehydes
Ketones
Carboxylic Acids
Carboxylic Acid Anhydrides
Esters and Lactones
Amides and Lactams
Imides
References
Miscellaneous Compounds
Trialkylsilyl Ethers
Phosphorus Compounds
References
Mass Spectra of Common Solvents and Matrix Compounds
Electron Impact Ionization Mass Spectra of Common Solvents
Spectra of Common FAB MS Matrix and Calibration Compounds
Spectra of Common MALDI MS Matrix Compounds
References
UV/Vis Spectroscopy
Correlation between Wavelength of Absorbed Radiation and Observed Color
Simple Chromophores
Conjugated Alkenes
Dienes and Polyenes
�,�-Unsaturated Carbonyl Compounds
Aromatic Hydrocarbons
Monosubstituted Benzenes
Polysubstituted Benzenes
Aromatic Carbonyl Compounds
Reference Spectra
Alkenes and Alkynes
Aromatic Compounds
Heteroaromatic Compounds
Miscellaneous Compounds
Nucleotides
Common Solvents
Subject Index
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