连氮香兰素(1696-60-2)核磁图(1HNMR)
分子式:C16H16N2O4
分子量: 300.31
InChI:InChI=1S/C16H16N2O4/c1-21-15-7-11(3-5-13(15)19)9-17-18-10-12-4-6-14(20)16(8-12)22-2/h3-10,19-20H,1-2H3
InChIKey: GGQDJSIYHIRXDW-UHFFFAOYSA-N
Smiles:C(=NN=CC1=CC=C(O)C(OC)=C1)C1=CC=C(O)C(OC)=C1
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Mass
MS-NW-7125
vanillin azine
C16H16N2O4 (Mass of molecular ion: 300)
Source Temperature: 220 °C
Sample Temperature: 160 °C
Direct, 75 eV
15.0 1.3
27.0 1.3
28.0 1.1
38.0 1.5
39.0 7.0
41.0 2.9
50.0 3.2
51.0 9.0
52.0 14.8
53.0 3.9
55.0 3.9
62.0 1.3
63.0 5.0
64.0 2.8
65.0 12.9
66.0 2.1
67.0 2.5
76.0 2.1
77.0 5.6
78.0 3.1
79.0 6.1
80.0 5.8
81.0 3.5
90.0 2.0
91.0 1.6
92.0 2.1
93.0 4.1
94.0 1.3
95.0 1.6
104.0 1.3
105.0 2.6
106.0 6.1
107.0 4.9
108.0 8.1
109.0 4.0
118.0 1.0
119.0 1.1
120.0 2.7
121.0 4.1
122.0 3.1
123.0 7.9
124.0 1.7
133.0 1.1
134.0 7.1
135.0 6.0
136.0 2.8
137.0 2.8
141.0 1.0
148.0 1.3
149.0 5.0
150.0 14.0
151.0 4.3
152.0 1.6
162.0 5.8
163.0 1.1
168.0 1.3
169.0 2.3
170.0 1.5
175.0 1.5
176.0 1.5
177.0 50.5
178.0 5.8
185.0 1.1
186.0 1.3
196.0 1.5
197.0 3.2
198.0 1.8
207.0 1.7
211.0 3.5
212.0 1.8
213.0 2.0
214.0 1.8
215.0 1.2
224.0 1.2
225.0 2.1
226.0 1.2
227.0 2.3
228.0 1.5
229.0 1.7
230.0 1.9
239.0 1.7
240.0 1.5
241.0 2.2
242.0 1.8
243.0 1.2
253.0 1.4
255.0 1.1
256.0 3.0
257.0 3.0
258.0 19.5
259.0 3.2
267.0 1.0
269.0 2.3
270.0 1.0
271.0 1.6
272.0 11.4
273.0 16.4
274.0 2.8
283.0 2.1
284.0 6.4
285.0 6.8
286.0 1.2
299.0 32.6
300.0 100.0
301.0 18.5
302.0 2.6