2-THIOURACIL-5-CARBOXYLIC ACID(23945-50-8) 1H NMR
Molecular FormulaC5H4N2O3S
Molecular Weight172.16
InChI
InChIKey
Smiles
-
Mass
MS-NW-7134
4-oxo-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylic acid
C5H4N2O3S (Mass of molecular ion: 172)
Source Temperature: 200 °C
Sample Temperature: 180 °C
Direct, 75 eV
14.0 1.1
17.0 2.0
18.0 8.6
25.0 1.2
26.0 1.7
27.0 4.2
28.0 27.5
29.0 2.2
32.0 5.9
33.0 1.4
38.0 3.2
39.0 5.5
40.0 13.6
41.0 11.6
42.0 15.7
43.0 2.5
44.0 13.9
45.0 8.0
46.0 1.5
51.0 3.0
52.0 5.6
53.0 21.4
54.0 1.3
55.0 2.7
57.0 2.0
58.0 3.9
59.0 18.9
60.0 12.6
61.0 1.7
64.0 4.0
67.0 6.3
68.0 20.3
69.0 21.0
70.0 8.4
71.0 1.9
72.0 2.4
73.0 1.2
76.0 1.0
83.0 1.1
84.0 1.8
85.0 33.0
86.0 8.6
87.0 1.2
94.0 1.2
95.0 1.9
96.0 4.2
98.0 1.7
100.0 6.6
101.0 1.0
110.0 1.7
112.0 1.3
113.0 1.1
114.0 3.9
126.0 2.8
127.0 1.4
128.0 49.9
129.0 3.3
130.0 2.9
144.0 1.2
154.0 5.5
155.0 2.0
172.0 100.0
173.0 7.5
174.0 5.6