document_2022 -- document_2022

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Resolver: mzspec:MS2LDA:TASK-551:accession:625956

Associated Mass2Motifs

The following table lists all Mass2Motifs that explain features extracted from this fragmentation spectra -- at the threshold specified in the experiment option.

Motif Probability Overlap Score Annotation
motif_148 0.427 0.976 None
motif_11 0.193 0.975 None
motif_225 0.186 0.725 None
motif_97 0.152 0.988 None

Fragmentation Spectrum Plot

The fragmentation spectrum of this molecule is plotted below, alongside associated Mass2Motifs. Features (fragments and losses) explained by the associated Mass2Motif are coloured in red, while the parent ion is coloured in blue.

Features

The following table lists all features extracted from this fragmentation spectra -- alongside Mass2Motifs that explain these features at the threshold specified in the experiment option. The column MAGMa Substructure Annotation shows substructures annotations from MAGMa. Hovering over each MAGMa substructure shows the plots of 10 random documents containing the substructure.

Name Intensity Mass2Motif (prob) MAGMa Substructure Annotation
fragment_226.9500 1000.0 motif_148 (1.000)
fragment_158.9500 791.0 motif_148 (0.241)
motif_11 (0.757)
fragment_90.9500 566.0 motif_97 (0.841)
motif_148 (0.159)
fragment_101.0500 419.0 motif_225 (0.989)
fragment_102.1500 135.0 motif_225 (1.000)
fragment_59.0500 70.0 motif_148 (0.021)
motif_225 (0.010)
motif_167 (0.968)
fragment_89.0500 40.0 motif_229 (0.998)
fragment_227.9500 40.0 motif_148 (1.000)
fragment_60.0500 18.0 motif_148 (0.156)
motif_225 (0.834)
fragment_969.6500 15.0 motif_148 (0.774)
motif_225 (0.226)
loss_74.1500 11.0 motif_148 (0.012)
motif_225 (0.980)
fragment_423.2500 11.0 motif_259 (0.999)
fragment_133.0500 10.0 motif_229 (0.999)
fragment_294.9500 4.0 motif_148 (1.000)
fragment_159.9500 4.0 motif_148 (0.314)
motif_11 (0.686)
fragment_199.0500 3.0 motif_97 (0.015)
motif_148 (0.016)
motif_225 (0.930)
motif_11 (0.037)
fragment_228.9500 1.0 motif_148 (1.000)
loss_198.2500 1.0 motif_97 (0.018)
motif_148 (0.061)
motif_225 (0.883)
motif_11 (0.030)
fragment_299.1500 1.0 motif_148 (0.027)
motif_225 (0.947)
motif_11 (0.013)