苯甲酰胞苷(13089-48-0)質(zhì)譜(MS)
分子式:C16H17N3O6
分子量: 347.32
InChI:InChI=1S/C16H17N3O6/c20-8-10-12(21)13(22)15(25-10)19-7-6-11(18-16(19)24)17-14(23)9-4-2-1-3-5-9/h1-7,10,12-13,15,20-22H,8H2,(H,17,18,23,24)/t10-,12-,13-,15-/m1/s1
InChIKey: BNXBRFDWSPXODM-BPGGGUHBSA-N
Smiles:OC[C@H]1O[C@@H](N2C=CC(NC(=O)C3=CC=CC=C3)=NC2=O)[C@H](O)[C@@H]1O
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Mass
MS-KW-0204
N(4)-benzoylcytidine
C16H17N3O6 (Mass of molecular ion: 347)
Source Temperature: 180 °C
Sample Temperature: 190 °C
Direct, 75 eV
15.0 1.6
17.0 2.7
18.0 13.7
19.0 1.8
26.0 2.5
27.0 5.1
28.0 13.1
29.0 6.7
30.0 2.0
31.0 4.1
38.0 1.8
39.0 4.8
40.0 3.0
41.0 4.7
42.0 5.6
43.0 6.9
44.0 5.6
45.0 2.9
50.0 4.5
51.0 10.2
52.0 3.3
53.0 1.4
54.0 1.7
55.0 5.0
56.0 2.3
57.0 9.3
58.0 1.4
60.0 2.5
61.0 2.0
66.0 1.4
67.0 2.8
68.0 4.6
69.0 6.5
70.0 1.8
71.0 3.5
72.0 1.2
73.0 6.8
74.0 2.3
75.0 1.5
76.0 4.4
77.0 41.9
78.0 6.4
79.0 2.0
83.0 1.4
84.0 1.8
85.0 2.4
86.0 1.5
94.0 3.3
95.0 4.8
96.0 3.4
97.0 2.3
103.0 6.6
104.0 1.9
105.0 100.0
106.0 7.8
111.0 6.0
112.0 32.2
113.0 3.1
114.0 1.0
115.0 1.1
118.0 3.3
121.0 1.2
122.0 9.7
123.0 2.4
138.0 7.5
140.0 15.1
141.0 1.3
151.0 7.9
152.0 1.0
154.0 1.4
170.0 2.4
171.0 1.0
178.0 1.4
186.0 7.8
187.0 3.4
214.0 6.4
215.0 11.2
216.0 10.7
217.0 1.5
244.0 5.7
245.0 1.0
255.0 4.0
274.0 1.1