databases > DOI:10.25504/FAIRsharing.nYaZ1N

ready nmrshiftdb2

General Information
nmrshiftdb2 is an NMR database for organic structures and their nuclear magnetic resonance (NMR) spectra. It allows for spectrum prediction (13C, 1H and other nuclei) as well as for searching spectra, structures and other properties. It also features peer-reviewed submission of datasets by its users. The nmrshiftdb2 software is open source, the data is published under an open content license.

Homepage http://www.nmrshiftdb.org

Countries that developed this resource Germany , United Kingdom

Created in 2003

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How to cite this record FAIRsharing.org: nmrshiftdb2; nmrshiftdb2; DOI: https://doi.org/10.25504/FAIRsharing.nYaZ1N; Last edited: Sept. 20, 2019, 11:51 a.m.; Last accessed: Oct 22 2019 10:35 a.m.

Publication for citation  Facilitating quality control for spectra assignments of small organic molecules: nmrshiftdb2--a free in-house NMR database with integrated LIMS for academic service laboratories. Kuhn S,Schlorer NE; Magn Reson Chem ; 2015; 10.1002/mrc.4263;


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Record added: May 29, 2019, 6:01 p.m.
Record updated: July 15, 2019, 11:52 a.m. by The FAIRsharing Team.

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Facilitating quality control for spectra assignments of small organic molecules: nmrshiftdb2--a free in-house NMR database with integrated LIMS for academic service laboratories.

Kuhn S,Schlorer NE
Magn Reson Chem 2015

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NMRShiftDB -- compound identification and structure elucidation support through a free community-built web database.

Steinbeck C,Kuhn S
Phytochemistry 2004

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NMRShiftDB-constructing a free chemical information system with open-source components.

Steinbeck C,Krause S,Kuhn S
J Chem Inf Comput Sci 2003

View Paper (PubMed) View Publication

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  • This record is maintained by shk3

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  • LI 2858/11 (Deutsche Forschungsgemeinschaft)