document_1 -- document_1

Return to experiment crusemann
Resolver: mzspec:MS2LDA:TASK-551:accession:624745

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_31 0.411 0.029 None
motif_248 0.169 0.449 None
motif_87 0.159 0.837 None
motif_32 0.089 0.305 None
motif_18 0.054 0.247 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_89.0500 1000.0 motif_87 (1.000)
fragment_189.0500 827.0 motif_248 (1.000)
loss_110.9500 827.0 motif_31 (1.000)
loss_139.0500 555.0 motif_32 (1.000)
fragment_160.9500 555.0 motif_31 (1.000)
fragment_205.0500 338.0 motif_18 (0.999)
loss_94.9500 338.0 motif_31 (0.999)
loss_146.0500 200.0 motif_143 (1.000)
fragment_153.9500 200.0 motif_31 (0.999)
fragment_70.0500 179.0 motif_221 (0.999)
loss_183.0500 160.0 motif_281 (0.999)
fragment_116.9500 160.0 motif_31 (0.999)
fragment_145.0500 145.0 motif_248 (0.998)
loss_154.9500 145.0 motif_31 (0.999)
fragment_147.9500 132.0 motif_31 (0.999)
loss_152.0500 132.0 motif_31 (0.999)
fragment_88.0500 114.0 motif_8 (0.999)
fragment_204.0500 92.0 motif_248 (0.976)
motif_18 (0.015)
loss_95.9500 92.0 motif_31 (0.998)
fragment_71.0500 83.0 motif_251 (1.000)