2-硝基苯-beta-D-半乳糖苷(369-07-3)紅外圖譜(IR2)
分子式:C12H15NO8
分子量: 301.25
InChI:InChI=1/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-4-2-1-3-6(7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9+,10+,11-,12-/s3
InChIKey: KUWPCJHYPSUOFW-IDEGKBHYNA-N
Smiles:O(C1C=CC=CC=1N(=O)=O)[C@H]1[C@@H]([C@@H](O)[C@@H](O)[C@@H](CO)O1)O |&1:10,11,12,14,16,r|
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Mass
MS-NW-2266
o-nitrophenyl beta-D-galactopyranoside
C12H15NO8 (Mass of molecular ion: 301)
Source Temperature: 230 °C
Sample Temperature: 190 °C
Direct, 75 eV
14.0 2.9
15.0 13.5
17.0 3.9
18.0 18.1
19.0 13.0
25.0 1.0
26.0 6.7
27.0 21.4
28.0 12.8
29.0 38.4
30.0 15.0
31.0 34.4
32.0 2.9
37.0 4.5
38.0 11.7
39.0 44.1
40.0 3.8
41.0 11.4
42.0 14.0
43.0 36.4
44.0 14.9
45.0 21.8
46.0 1.0
47.0 4.5
49.0 1.3
50.0 5.4
51.0 10.0
52.0 5.6
53.0 11.9
54.0 3.0
55.0 19.1
56.0 13.1
57.0 36.7
58.0 4.5
59.0 2.8
60.0 49.8
61.0 17.8
62.0 5.9
63.0 24.6
64.0 23.1
65.0 43.2
66.0 4.3
67.0 1.5
68.0 3.0
69.0 14.3
70.0 10.2
71.0 20.0
72.0 11.0
73.0 64.3
74.0 11.5
75.0 3.0
76.0 1.4
77.0 2.1
78.0 7.6
79.0 1.7
80.0 3.6
81.0 23.5
82.0 1.6
83.0 1.1
84.0 2.1
85.0 16.1
86.0 5.6
87.0 8.6
88.0 1.4
89.0 4.3
90.0 3.5
91.0 23.0
92.0 10.0
93.0 13.1
94.0 7.0
95.0 2.4
96.0 2.1
97.0 8.8
98.0 5.9
99.0 2.5
101.0 4.5
102.0 3.8
103.0 4.0
106.0 6.0
109.0 25.1
110.0 2.0
113.0 3.5
114.0 2.5
115.0 3.2
116.0 1.5
119.0 1.3
122.0 10.1
123.0 7.7
124.0 1.1
127.0 2.4
131.0 2.1
132.0 1.2
133.0 2.1
139.0 100.0
140.0 8.0
144.0 4.8
145.0 3.2