苯基硫代乙内酰脲-谷氨酰胺(10567-86-9)核磁图(13CNMR)
分子式:C12H13N3O2S
分子量: 263.32
InChI:InChI=1S/C12H13N3O2S/c13-10(16)7-6-9-11(17)15(12(18)14-9)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H2,13,16)(H,14,18)
InChIKey: UNCINZHSIAEDPO-UHFFFAOYSA-N
Smiles:C1(=S)N(C2=CC=CC=C2)C(=O)C(CCC(N)=O)N1
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Mass
MS-NW-2059
5-(2-carbamoylethyl)-3-phenyl-2-thioxo-4-imidazolidone
C12H13N3O2S (Mass of molecular ion: 263)
Source Temperature: 200 °C
Sample Temperature: 240 °C
Direct, 75 eV
14.0 1.8
15.0 1.8
16.0 3.4
17.0 5.4
18.0 25.0
26.0 8.2
27.0 18.2
28.0 21.4
29.0 1.9
30.0 2.0
32.0 7.9
33.0 3.4
34.0 10.2
37.0 3.4
38.0 7.3
39.0 19.9
40.0 6.8
41.0 21.4
42.0 6.9
43.0 7.6
44.0 15.7
45.0 3.6
50.0 10.8
51.0 34.4
52.0 10.2
53.0 7.9
54.0 14.0
55.0 14.9
56.0 8.0
57.0 1.8
58.0 2.9
59.0 39.4
60.0 2.9
61.0 1.4
62.0 1.9
63.0 6.5
64.0 9.7
65.0 9.7
66.0 7.7
67.0 2.9
68.0 3.0
69.0 1.9
70.0 8.2
71.0 2.4
72.0 3.7
73.0 4.4
74.0 2.6
75.0 3.4
76.0 9.4
77.0 100.0
78.0 11.1
79.0 1.4
80.0 3.4
81.0 4.0
82.0 4.1
83.0 6.9
84.0 8.0
85.0 6.9
86.0 14.1
87.0 1.5
88.0 1.5
89.0 1.6
90.0 3.5
91.0 13.5
92.0 8.3
93.0 34.8
94.0 5.5
95.0 3.6
96.0 1.4
97.0 1.7
98.0 5.8
99.0 6.1
100.0 2.3
101.0 1.2
102.0 1.0
103.0 17.7
104.0 45.0
105.0 9.7
106.0 2.6
108.0 9.6
109.0 13.0
110.0 2.4
111.0 13.8
112.0 4.2
116.0 1.1
117.0 7.3
118.0 7.4
119.0 14.3
120.0 13.4
121.0 1.4
123.0 1.0
124.0 1.4
125.0 2.2
126.0 4.6
127.0 1.9
128.0 2.0
129.0 1.3
130.0 4.0
131.0 2.7
132.0 2.5
133.0 2.1
134.0 1.7
135.0 72.9
136.0 33.2
137.0 6.1
138.0 1.7
142.0 1.7
143.0 2.1
144.0 2.5
145.0 4.9
146.0 6.6
147.0 1.8
149.0 1.1
150.0 1.4
151.0 2.5
156.0 1.3
157.0 2.5
158.0 2.5
159.0 2.2
160.0 4.2
161.0 1.4
162.0 1.1
163.0 1.5
168.0 1.5
170.0 1.7
171.0 1.4
172.0 7.5
173.0 3.0
174.0 1.7
175.0 3.3
176.0 1.3
184.0 2.4
185.0 3.1
186.0 6.7
187.0 5.0
188.0 2.2
189.0 5.5
190.0 1.2
191.0 2.7
192.0 7.6
193.0 1.1
201.0 1.2
202.0 2.5
203.0 24.2
204.0 49.9
205.0 25.1
206.0 5.2
207.0 1.3
211.0 2.4
212.0 3.2
213.0 3.6
214.0 6.5
215.0 1.4
216.0 6.4
217.0 8.6
218.0 21.0
219.0 3.7
220.0 1.7
229.0 3.1
230.0 1.1
231.0 2.5
242.0 1.4
243.0 6.6
244.0 16.3
245.0 33.0
246.0 59.4
247.0 9.8
248.0 3.5
261.0 4.5
263.0 51.2
264.0 7.8
265.0 3.0