5-溴尿苷(957-75-5)紅外圖譜(IR1)
分子式:C9H11BrN2O6
分子量: 323.1
InChI:InChI=1S/C9H11BrN2O6/c10-3-1-12(9(17)11-7(3)16)8-6(15)5(14)4(2-13)18-8/h1,4-6,8,13-15H,2H2,(H,11,16,17)/t4-,5-,6-,8-/m1/s1
InChIKey: AGFIRQJZCNVMCW-UAKXSSHOSA-N
Smiles:OC[C@H]1O[C@@H](N2C=C(Br)C(=O)NC2=O)[C@H](O)[C@@H]1O
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Mass
MS-NW-2017
5-bromouridine
C9H11BrN2O6 (Mass of molecular ion: 322)
Source Temperature: 220 °C
Sample Temperature: 280 °C
Direct, 75 eV
24.0 2.1
25.0 7.3
26.0 18.1
27.0 34.4
28.0 100.0
29.0 27.2
30.0 5.1
31.0 15.6
36.0 1.5
37.0 4.3
38.0 25.5
39.0 42.1
39.5 1.8
40.0 58.7
40.5 1.6
41.0 34.8
42.0 68.2
43.0 43.0
44.0 51.0
45.0 5.1
46.0 2.4
50.0 3.7
51.0 13.0
52.0 4.1
53.0 9.7
54.0 6.5
55.0 14.7
56.0 5.6
57.0 5.8
58.0 2.0
60.0 2.5
61.0 1.4
64.0 2.7
65.0 12.2
66.0 11.3
67.0 28.5
68.0 28.8
69.0 85.3
70.0 8.8
71.0 3.3
72.0 1.4
73.0 3.0
74.0 1.4
77.0 1.1
79.0 27.2
80.0 78.4
81.0 26.9
82.0 84.1
83.0 1.7
84.0 4.5
85.0 2.9
86.0 1.6
91.0 4.2
92.0 7.6
93.0 4.2
94.0 18.7
95.0 7.7
96.0 7.7
97.0 3.9
98.0 1.5
104.0 4.4
106.0 4.4
107.0 1.1
108.0 3.3
109.0 1.0
110.0 5.0
111.0 2.1
112.0 96.7
113.0 6.2
114.0 2.5
117.0 5.4
118.0 3.4
119.0 6.5
120.0 38.2
121.0 3.0
122.0 32.5
123.0 1.3
127.0 1.9
128.0 2.6
133.0 1.1
135.0 1.0
145.0 5.4
146.0 2.3
147.0 62.4
148.0 4.7
149.0 62.0
150.0 3.7
172.0 13.0
174.0 14.0
175.0 1.4
176.0 1.2
190.0 47.6
191.0 2.9
192.0 48.1
193.0 2.7