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Table 2015.12D. TraceFinder software compound database for the target compound panel
Compound name
Chemical
Formula
Extracted
mass
Adduct
RT
Fragment ions (
m/z
)
Acetaminotadalafil
C
23
H
20
N
4
O
5
433.15065
M+H
5.33
204.08078; 262.08626;
135.04406; 205.08860;
233.08352; 232.07569;
169.07602; 191.07295;
263.09408; 250.08626
Acetildenafil
C
25
H
34
N
6
O
3
467.27652
M+H
4.50
111.09167; 97.07602;
70.06513; 84.08078;
72.08078; 127.12297;
112.09950; 297.13460;
56.04948; 166.09749
Avanafil
C
23
H
26
ClN
7
O
3
484.18584
M+H
5.03
155.02582; 375.12184;
105.03349; 77.03858;
95.04914; 53.03858;
357.11128; 233.10330;
67.05423; 221.10330
Homosildenafil
C
23
H
32
N
6
O
4
S
489.22785
M+H
5.23
72.08078; 58.06513;
99.09167; 113.10732;
70.06513; 283.11895;
84.08078; 71.07295;
114.11515; 311.15025
Hydroxyacetildenafil
C
25
H
34
N
6
O
4
483.27143
M+H
4.21
97.07602; 70.06513;
127.08659; 143.11789;
100.07569; 297.13460;
88.07569; 166.09749;
112.09950; 128.09441
Hydroxyhomo
sildenafil
C
23
H
32
N
6
O
5
S
505.22277
M+H
5.01
99.09167; 70.06513;
58.06513; 84.06820;
97.07602; 283.11895;
88.07569; 129.10224;
112.0995; 311.15025
Hydroxythiohomo
sildenafil
C
23
H
32
N
6
O
4
S
2
521.19992
M+H
8.75
99.09167; 70.06513;
58.06513; 84.06820;
299.09611; 129.10224;
97.07602; 88.07569;
327.12741; 112.09950
Lodenafil carbonate C
47
H
62
N
12
O
11
S
2
1035.41752
M+H
12.9
3
112.09950; 82.06513;
97.07602; 111.09167;
487.21220; 83.06037;
84.08078; 283.11895
Mirodenafil
C
26
H
37
N
5
O
5
S
532.25882
M+H
7.93
99.09167; 296.13935;
312.13427; 70.06513;
56.04948;84.06820;
210.06619; 129.10224;
88.07569; 121.03964
Candidates for 2016 Method of the Year
153