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Spectra Resources on the Internet
- NIST WebBook
Contains IR spectra for over 16,000 compounds
and mass spectra for over 15,000 compounds.
- NMRShiftDB
"NMRShiftDB is a web database for organic structures and their nuclear magnetic resonance
(nmr) spectra. It allows for spectrum prediction (currently only for carbon) as well as for
searching spectra, structures and other properties. Last not least, it features peer-reviewed
submission of datasets by its users. The NMRShiftDB software is open source, the data is
published under an open content license."
- Spectra Online (Thermo Galactic)
The database spans many different classes of
compounds including drugs, common chemicals, polymers, petroleum
products among others. It includes spectral data from many
different instrument types such as FT-IR, UV-Vis, NIR, Raman, MS,
NMR (13C, 1H and others), XRD and more. Please note that Thermo
Galactic does not review the data in the collections; all spectra
and related compound information are presented "as-is" in the
form they we received."
- Spectral Database for Organic Compounds (SDBS)
SDBS is an integrated spectral database system for organic compounds.
- WorldWideMolecularMatrix
The WorldWideMolecularMatrix, an Open collection of information on small molecules
For a Help Guide on using Spectra Resources, go to
Spectra Resources or
Spectra Identification.
