S61 | UJICCSLIB | Collision Cross Section (CCS) Library from UJI
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资源简介：
A list of 970 collision cross section values from 556 compounds (both positive and negative ionization modes, drift gas nitrogen, using a TWIMS-QTOF instrument) provided by Alberto Celma et al. (2020) DOI: 10.1021/acs.est.0c05713 from University Jaume I, Castellon, Spain. Dataset DOI: 10.5281/zenodo.3549476. Update 10 April 2020: added charge information in an extra column to the xlsx and csv files, for PubChem integration. InChIKey and DTXSID files did not change. 30 Jul 2020: fixed adduct/charge mismatches in CSV.
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Zenodo创建时间：
2020-07-30
