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Mass Spectra of Organic Compounds (SpecData)
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Structural Diversity for Drug Discovery Mass Spectra of Organic Compounds 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. Each record contains: Spectrum Chemical structure Chemical name Molecular formula Molecular weight (Nominal mass) Base peak Reference Measurement condition Verify Compound Coverage Labs can freely verify compound coverage at Compound Search . Exceptional Value Mass Spectra of Organic Compounds is an exceptional value for labs focused on combinatorial synthesis. Availability 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
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