Metabolite Spectrum Accession: MALB00047p
m/z
intensity
53.00306
1.1
53.03937
1.3
54.03233
0.6
54.03470
5.1
54.93822
0.4
55.01869
5.9
55.02985
0.6
55.05505
2.8
55.93516
1.5
56.05034
10.6
56.96563
44.0
57.03437
6.5
57.04555
1.1
57.05814
0.9
57.07081
0.5
58.02948
1.8
58.06304
0.5
58.06596
9.3
59.06123
1.0
60.04512
2.2
65.03947
2.2
67.01861
12.8
67.02988
3.3
67.05502
14.4
68.01392
0.7
68.05024
13.9
68.99791
1.6
69.03421
3.2
69.04556
1.5
69.07059
2.7
69.69617
2.1
69.70036
0.6
70.02952
14.8
70.03764
0.9
70.06589
12.4
71.01349
1.6
71.04986
4.1
71.06110
1.7
71.06931
0.5
71.94099
11.2
71.95251
5.4
72.04514
7.4
72.05641
0.6
72.08150
5.1
72.93784
66.0
73.05291
6.1
74.04819
11.4
74.97594
1.0
78.03446
1.0
79.05491
2.9
80.04993
0.5
81.03381
0.6
81.04523
2.5
81.05789
1.5
82.05331
0.4
83.04966
0.6
83.06104
5.8
83.97627
1.5
84.04502
1.9
84.05615
0.8
84.06892
1.8
84.08115
0.8
85.02906
3.3
85.04028
0.5
85.06548
1.1
85.07672
2.9
85.08456
0.7
86.06068
6.8
86.07984
0.4
87.05588
1.8
89.70273
0.4
89.95143
1.5
90.94822
30.7
91.02337
0.4
95.01330
8.2
95.02442
1.2
95.04974
4.1
95.06084
9.4
95.08589
0.9
96.00851
7.9
96.04488
4.5
96.05618
0.8
96.06882
0.9
96.08121
8.8
97.02888
0.8
97.06448
0.9
97.07650
0.6
98.21402
0.9
98.98470
0.4
100.02479
0.8
101.98635
0.8
107.96210
0.6
108.95855
15.0
111.02931
0.6
112.96742
0.6
113.00021
21.0
113.02360
100.0
113.03480
11.4
113.06004
5.2
113.07128
10.9
113.07937
2.0
113.10764
6.9
113.96393
4.4
114.02709
1.8
114.03900
0.4
114.05515
2.6
114.06657
3.7
114.09162
7.8
114.10293
1.0
114.12790
1.3
116.98572
0.4
118.03500
0.8
119.99707
0.4
126.96913
0.5
130.97742
0.8
131.00166
0.6
131.01071
0.5
131.97432
6.5
131.99658
0.8
134.99614
0.8
MS Level
MS2
Instrument
Q Exactive Orbitrap (Thermo Scientific)
Instrument Type
UPLC-ESI-Q-Orbitrap
Collision Energy
27.50(15eV,40eV)
Ion Mode
positive
Precursor Type
[M+H]+
Precursor m/z
113.0236
Retention Time
1.22 min
Identification Level
In-silico
Match Score
0.35279927