The Metabolite Spectrum Accession: HMAC00033p
m/z
intensity
53.03948
3.7
54.03469
1.7
55.01876
10.6
55.05509
7.6
55.93525
0.9
56.05035
9.5
56.96565
90.8
57.03437
9.0
57.04552
1.0
57.05814
3.7
57.07073
1.4
58.02950
1.3
58.03775
0.5
58.06598
6.5
58.99593
0.4
58.99863
1.7
59.05008
3.5
60.04524
0.7
60.95848
1.6
61.02922
1.3
65.41880
0.4
67.01877
0.9
67.02964
0.5
67.04242
0.5
67.05506
3.2
68.02187
0.6
68.02621
0.6
68.05029
14.5
68.05828
0.5
68.99797
1.0
69.03432
12.9
69.04539
3.4
69.07068
13.3
70.02956
8.2
70.06596
20.0
70.47601
0.4
70.79820
0.9
70.80153
0.5
70.98109
1.5
70.99818
0.4
71.01350
2.3
71.02451
3.0
71.03286
12.2
71.04988
5.5
71.06088
0.9
71.06941
1.1
71.07378
0.4
71.08626
0.9
71.94093
1.9
71.95271
2.8
72.04519
19.9
72.05660
0.5
72.08150
5.7
72.93787
74.6
72.96043
1.5
73.02920
3.3
73.04021
0.7
73.06551
0.6
73.07685
1.1
73.93814
0.8
74.04820
2.9
74.06078
3.5
74.50040
0.6
74.97590
2.9
75.01052
0.8
75.01921
0.5
75.04494
0.5
76.02683
0.5
77.00880
4.7
78.52964
0.9
79.05493
8.9
80.02938
0.4
80.05011
1.9
81.01923
0.5
81.03415
1.4
81.05798
4.0
81.99993
0.7
82.01438
1.3
82.02645
0.5
82.05327
0.7
82.06567
1.2
83.00772
1.2
83.01321
0.9
83.04971
1.0
83.06111
0.8
83.50547
4.4
83.97629
3.9
84.01572
1.8
84.04501
1.1
84.08140
9.7
84.96031
1.1
85.02901
3.5
85.04035
0.7
85.05289
10.1
85.08469
0.8
85.08932
0.9
86.01306
1.8
86.03233
0.5
86.06062
10.7
86.07198
0.8
86.09707
18.2
87.00820
1.0
87.01902
0.6
87.04484
2.3
87.05595
1.2
87.09246
0.9
87.10036
0.6
87.53462
0.5
88.02695
2.3
88.05118
2.2
88.51577
0.8
88.99155
1.3
89.00812
1.0
90.01546
0.5
90.94825
30.4
91.00520
3.7
91.02363
0.5
91.03210
0.5
91.94871
0.5
92.01299
0.6
92.51073
1.3
92.98669
1.3
93.01920
0.6
93.53474
0.5
94.06570
1.6
95.01370
0.8
95.01949
2.9
95.04961
1.1
96.00861
0.8
96.02783
1.5
96.04492
1.5
96.05663
2.5
96.06178
0.5
96.08129
18.2
97.00597
0.6
97.01183
12.6
97.02281
0.7
97.02866
6.5
97.04003
2.2
97.05949
0.6
97.06530
4.6
97.07650
4.3
97.08427
0.8
97.52115
0.9
97.99199
0.8
98.01281
3.3
98.03532
1.5
98.06051
2.0
98.52756
0.5
98.53584
0.4
98.97583
2.4
99.02095
0.5
99.06828
0.6
99.53492
0.5
100.01048
2.9
100.02473
16.3
101.00868
1.9
101.02588
2.1
101.98669
1.5
102.02338
2.3
102.52498
0.7
102.53115
1.2
103.00539
0.8
103.02401
1.1
105.00333
1.7
105.08642
1.8
107.00169
1.1
107.01800
0.4
108.95863
14.4
109.02874
0.5
109.08904
0.5
110.97562
0.5
111.00272
1.0
111.02968
5.4
111.03713
0.8
111.09241
0.4
111.52998
1.5
111.53654
5.5
112.02816
1.7
112.03742
1.1
112.07633
2.4
112.54424
1.3
113.00896
0.8
113.96423
3.2
114.02698
9.3
114.03829
23.1
114.05534
17.9
114.06647
3.9
114.09165
100.0
114.10283
4.8
115.02405
1.9
115.03930
3.9
115.05057
1.1
115.06198
0.9
115.08687
3.8
115.09510
2.3
116.00204
0.8
116.98622
3.7
118.01126
0.8
118.03519
21.5
119.01066
1.0
119.01920
17.3
119.03622
2.4
119.99706
1.4
120.02018
1.8
120.03333
2.0
120.54160
1.5
121.01628
2.0
121.03458
1.4
121.54917
0.5
122.09628
0.5
122.52168
0.6
123.01347
1.3
123.04005
0.7
124.02456
0.5
126.96914
0.7
128.98584
0.8
131.01900
8.6
131.97435
5.7
131.99666
1.5
132.01994
1.6
132.05064
1.5
132.97849
0.5
133.01625
2.3
133.03476
4.0
134.01239
0.8
134.99648
3.7
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
114.0917
Retention Time
1.166 min