奎諾二甲基酯(81-93-6)紅外圖譜(IR1)
分子式:C18H15ClN4
分子量: 322.8
InChI:InChI=1S/C18H14N4.ClH/c19-12-6-8-15-17(10-12)22(14-4-2-1-3-5-14)18-11-13(20)7-9-16(18)21-15;/h1-11H,(H3,19,20);1H
InChIKey: SOUHUMACVWVDME-UHFFFAOYSA-N
Smiles:[N+]1(C2C=CC=CC=2)C2=CC(=CC=C2N=C2C=CC(N)=CC=12)N.[Cl-]
-
Mass
MS-NW-0724
phenosafranine
C18H15ClN4 (Mass of molecular ion: 322)
Source Temperature: 170 °C
Sample Temperature: 180 °C
Direct, 75 eV
16.0 5.5
17.0 6.6
18.0 13.4
26.0 4.8
27.0 13.9
28.0 34.6
29.0 1.9
32.0 3.0
35.0 6.6
36.0 45.0
37.0 2.1
38.0 14.4
39.0 8.7
40.0 1.7
41.0 7.5
42.0 2.1
43.0 3.9
44.0 4.2
50.0 4.3
51.0 9.8
52.0 6.6
53.0 2.3
54.0 2.2
55.0 3.9
56.0 2.0
57.0 3.8
62.0 1.8
63.0 5.6
64.0 3.7
65.0 5.6
66.0 3.4
67.0 2.7
68.0 1.5
69.0 2.6
70.0 1.5
71.0 2.0
74.0 1.3
75.0 1.7
76.0 2.5
77.0 10.8
78.0 17.3
79.0 3.6
80.0 1.9
81.0 2.1
82.0 1.4
83.0 2.2
84.0 1.1
85.0 1.4
88.0 1.0
89.0 2.1
90.0 3.5
91.0 4.8
91.5 1.4
92.0 6.5
93.0 7.3
94.0 1.2
95.0 1.4
96.0 1.2
97.0 1.8
98.0 1.6
101.0 1.2
102.0 1.9
103.0 1.8
104.0 2.0
105.0 3.8
105.5 1.1
106.0 1.3
107.0 1.5
108.0 2.5
109.0 1.0
111.0 1.1
114.0 1.2
115.0 3.2
115.5 1.0
116.0 2.0
117.0 2.8
118.0 1.3
121.0 1.2
127.0 1.4
128.0 2.4
128.5 2.6
129.0 5.0
129.5 2.5
130.0 1.6
131.0 1.0
134.0 1.0
134.5 1.6
135.0 2.4
135.5 2.0
136.0 1.0
136.5 1.5
139.0 1.1
140.0 1.8
141.0 1.2
142.0 2.3
142.5 5.7
143.0 10.4
143.5 6.4
144.0 12.5
144.5 2.3
152.0 1.1
153.0 1.0
154.0 1.2
155.0 4.0
156.0 1.9
157.0 1.0
166.0 1.5
167.0 2.2
168.0 3.6
169.0 1.5
179.0 1.4
180.0 1.8
181.0 2.1
182.0 7.9
183.0 12.5
184.0 4.1
192.0 1.1
193.0 1.1
194.0 2.8
195.0 5.3
196.0 10.8
197.0 2.0
205.0 1.1
208.0 1.4
209.0 2.7
210.0 27.4
211.0 57.3
212.0 8.9
213.0 1.0
229.0 1.4
230.0 1.0
231.0 1.9
232.0 1.0
241.0 1.2
242.0 2.6
243.0 4.1
244.0 1.7
245.0 1.0
255.0 1.0
256.0 1.5
257.0 4.3
258.0 14.0
259.0 23.3
260.0 8.2
261.0 1.4
268.0 1.6
269.0 1.1
270.0 8.1
271.0 3.3
272.0 4.8
273.0 13.7
274.0 3.7
283.0 1.4
284.0 2.3
285.0 19.2
286.0 48.3
287.0 63.9
288.0 100.0
289.0 19.9
290.0 2.5
301.0 1.7
302.0 1.8
303.0 2.2
362.0 1.8
363.0 1.0
364.0 1.2