Nuclear magnetic resonance (NMR) spectroscopy is arguably the most powerful analytical tool available for the study of molecular structures. One of the most elegant attributes of NMR is that the information provided, primarily in the form of chemical shift, signal intensities, and spin–spin coupling (J‐coupling), is intrinsic to the nature of the molecular system being studied. As such the structures of compounds present may be deduced by applying the underlying logic that follows from a first principal understanding of the environmental and structural factors that control the output of an NMR measurement. Indeed, NMR is of primary importance in many scientific disciplines that rely on a precise understanding of molecular structures. Interest in the use of NMR as a tool to better understand environmental systems is growing as the underlying paradigm for environmental protection, monitoring, and remediation shifts away from tackling the known and critical environmental problems of the 1970s and 1980s towards a growing concern for the unknown environmental problems that have not yet been fully uncovered or understood. This article discusses the application of NMR spectroscopy as an analytical tool that has the potential to improve our understanding of the distribution and behavior of contaminants in the environment.