Mass Spectra of Organic Compounds (SpecData)

<p><b>Structural Diversity for Drug Discovery</b></p> <p><i><b>Mass Spectra of Organic Compounds</b></i> contains 37,055 mass spectra of organic compounds. The data were acquired from quality control in combinatorial synthesis and cover a wide range of structure classes. The compounds are applied for screening purposes in drug discovery.</p> <p>Each record contains:</p> <ol> <li>Spectrum</li> <li>Chemical structure</li> <li>Chemical name</li> <li>Molecular formula</li> <li>Molecular weight (Nominal mass)</li> <li>Base peak</li> <li>Reference</li> <li>Measurement condition</li> </ol> <p><b>Verify Compound Coverage</b></p> <p>Labs can freely verify compound coverage at <a href=”http://www.compoundsearch.com/”>Compound Search</a>.</p> <p><b>Exceptional Value</b></p> <p><i><b>Mass Spectra of Organic Compounds</b></i> is an exceptional value for labs focused on combinatorial synthesis.</p> <p><b>Availability</b></p> <p>Benchtop/SPC, Excalibur, Finnigan ICIS, Finnigan INCOS, Finnigan Ion-Trap, Finnigan Magnum, Finnigan GCQ, Finnigan SSQ, Finnigan TSQ, Finnigan ITS-40, Fisons VG Masslab, Fisons VG LabBase, Agilent Chemstation , NetCDF, NIST MSSEARCH, PE Turbomass, Shimadzu QP-5000, Varian Saturn</p>