辛可寧(118-10-5)紅外圖譜(IR1)
分子式:C19H22N2O
分子量: 294.39
InChI:InChI=1S/C19H22N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18-19,22H,1,8,10-12H2/t13-,14-,18+,19-/m0/s1
InChIKey: KMPWYEUPVWOPIM-QAMTZSDWSA-N
Smiles:[C@@H](O)([C@@H]1[N@]2CC[C@H]([C@H](C2)C=C)C1)C1=CC=NC2=CC=CC=C12
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Mass
MS-IW-0991
cinchonine
C19H22N2O (Mass of molecular ion: 294)
Source Temperature: 180 °C
Sample Temperature: 140 °C
Direct, 75 eV
17.0 1.1
18.0 7.5
29.0 1.0
30.0 1.1
39.0 1.1
41.0 4.2
42.0 6.2
43.0 1.1
44.0 3.0
53.0 2.3
54.0 1.1
55.0 7.3
56.0 3.8
57.0 1.1
66.0 1.0
67.0 2.7
68.0 1.9
69.0 1.6
70.0 1.8
77.0 2.2
79.0 5.7
80.0 2.4
81.0 11.9
82.0 7.7
83.0 1.7
91.0 1.2
93.0 3.3
94.0 2.9
95.0 6.6
96.0 1.7
105.0 1.9
107.0 1.4
108.0 3.7
109.0 2.2
110.0 2.7
111.0 2.2
115.0 1.1
121.0 1.0
122.0 2.6
123.0 1.4
124.0 3.9
126.0 2.4
128.0 2.1
129.0 2.6
130.0 6.4
134.0 1.7
135.0 1.0
136.0 100.0
137.0 12.4
138.0 10.9
139.0 2.4
142.0 2.4
143.0 10.7
144.0 1.7
152.0 1.4
154.0 1.5
156.0 3.2
157.0 1.6
158.0 3.6
159.0 13.0
160.0 1.6
166.0 1.1
167.0 1.7
168.0 2.5
169.0 1.8
170.0 1.7
171.0 1.5
172.0 1.5
183.0 1.1
184.0 1.9
237.0 1.1
239.0 1.3
253.0 4.1
265.0 1.1
267.0 1.6
277.0 1.6
293.0 1.9
294.0 21.8
295.0 5.2
296.0 3.8