Rhodanine-3-acetic acid(5718-83-2) MS
Molecular FormulaC5H5NO3S2
Molecular Weight191.23
InChIInChI=1S/C5H5NO3S2/c7-3-2-11-5(10)6(3)1-4(8)9/h1-2H2,(H,8,9)
InChIKey JGRMXPSUZIYDRR-UHFFFAOYSA-N
SmilesS1CC(=O)N(CC(O)=O)C1=S
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Mass
MS-NW-4634
4-oxo-2-thioxo-3-thiazolidineacetic acid
C5H5NO3S2 (Mass of molecular ion: 191)
Source Temperature: 170 °C
Sample Temperature: 120 °C
Direct, 75 eV
14.0 3.8
15.0 2.8
17.0 2.7
18.0 11.6
28.0 11.4
29.0 2.4
30.0 2.1
31.0 3.2
32.0 2.7
40.0 1.6
41.0 1.7
42.0 19.0
43.0 4.6
44.0 4.7
45.0 29.3
46.0 55.7
47.0 4.7
48.0 2.6
56.0 3.0
58.0 1.6
59.0 4.4
60.0 3.9
61.0 2.6
64.0 21.0
66.0 1.9
69.0 5.6
70.0 3.2
71.0 3.7
72.0 57.2
73.0 7.8
74.0 12.0
76.0 8.3
77.0 6.6
78.0 8.9
86.0 2.1
87.0 2.6
89.0 1.6
90.0 6.7
91.0 1.8
97.0 1.7
99.0 6.0
100.0 1.2
104.0 4.4
105.0 1.6
106.0 1.2
115.0 21.4
116.0 17.4
117.0 10.7
118.0 17.1
119.0 1.6
120.0 1.0
145.0 4.1
146.0 2.8
147.0 2.2
149.0 7.9
163.0 1.2
173.0 15.7
174.0 1.5
175.0 1.7
191.0 100.0
192.0 7.8
193.0 10.4