NMR

[Details Courtesy - ACD/Labs Website]


ACD/NMR Predictors

Quickly and accurately predict 1D and 2D NMR spectra, chemical shifts, and coupling constants for 1H, 13C, 15N, 19F, 31P nuclei. The highly accurate algorithms can be further trained with additional user data for customized performance.

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ACD/Spectrus Processor

Process and interpret all analytical data in one common interface, including NMR, LC/GC/UV/MS, IR, and more. Gain assistance with routine structure verification and access to spectral databases.

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ACD/NMR Workbook Suite

With synchronized peak-picking among related spectra, powerful structure assignment tools, and complete project management including databasing capabilities, ACD/NMR Workbook Suite is the ultimate software tool for structure characterization by NMR.

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ACD/Structure Elucidator Suite

A complete software package to help in the elucidation of unknown structures, providing results in an unbiased fashion. Either use experimental data to carry out a full elucidation resulting in a list of all possible structures that fit the data; or enter a proposed structure and let the software predict the 1D and 2D NMR spectra and propose alternative structures.

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Automated Structure Verification

Automate the process of assessing the fit between proposed structure and experimental data, so that only ambiguous or inconsistent structures have to be evaluated manually.

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