Neutral Loss Mass Spectral Data Enhances Molecular Similarity Analysis in METLIN.
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DOI: 10.1021/jasms.1c00343
Abstract: Neutral loss (NL) spectral data presents a mirror of MS2 data and is a valuable yet largely untapped resource for molecular discovery and similarity analysis. Tandem mass spectrometry (MS2) data is effective for the identification… read more here.
Keywords: ms2 data; spectral data; similarity; neutral loss ... See more keywords