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Chemistry Dashboard Data: Massbank Fragment File

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Figshare2018-05-10 更新2026-04-08 收录
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https://figshare.com/articles/Tandem_Mass_Spectrometry_Fragment_Summary_File_08_22_2017/5588680/2
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资源简介:
A new “Tandem Mass Spectrometry Fragment Summary File” has been added to the downloads page for our mass spectrometry users. This file contains DTXSIDs, structural and neutral mass information from the CompTox Chemistry Dashboard mapped to precursor and MS/MS fragment summaries from mass spectral records submitted to European MassBank (MassBank.EU) and contained within the MASSBANKREF and MASSBANKEUSP lists. For more details download the ZIP file and examine the README file.
提供机构:
EPA's National Center For Computational Toxicology
创建时间:
2018-05-10
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