油酸乙酯(111-62-6)紅外圖譜(IR1)
InChI:InChI=1S/C20H38O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h11-12H,3-10,13-19H2,1-2H3/b12-11-
InChIKey: LVGKNOAMLMIIKO-QXMHVHEDSA-N
Smiles:C(OCC)(=O)CCCCCCC/C=C\CCCCCCCC
-
Mass
MS-NW-8757
ethyl cis-9-octadecenoate
C20H38O2 (Mass of molecular ion: 310)
Source Temperature: 150 °C
Sample Temperature: 100 °C
Direct, 75 eV
18.0 1.2
27.0 8.8
28.0 3.9
29.0 35.0
39.0 7.1
40.0 1.5
41.0 63.3
42.0 11.3
43.0 54.2
44.0 1.9
45.0 6.7
53.0 6.1
54.0 23.5
55.0 100.0
56.0 21.5
57.0 34.7
58.0 2.0
59.0 2.4
60.0 9.8
61.0 11.2
65.0 1.9
66.0 2.2
67.0 40.5
68.0 25.8
69.0 71.8
70.0 34.0
71.0 18.0
72.0 1.1
73.0 16.7
74.0 2.0
77.0 2.2
78.0 1.3
79.0 10.1
80.0 7.5
81.0 40.1
82.0 26.4
83.0 60.3
84.0 52.9
85.0 12.1
86.0 1.1
87.0 4.7
88.0 89.6
89.0 16.3
90.0 1.1
91.0 3.2
92.0 1.1
93.0 6.5
94.0 8.1
95.0 31.3
96.0 52.8
97.0 53.6
98.0 46.8
99.0 7.3
100.0 1.3
101.0 58.7
102.0 5.3
105.0 1.8
107.0 5.3
108.0 6.2
109.0 19.4
110.0 27.2
111.0 28.0
112.0 11.0
113.0 3.5
114.0 1.9
115.0 10.5
116.0 1.4
119.0 4.4
120.0 1.8
121.0 7.2
122.0 3.9
123.0 19.7
124.0 14.0
125.0 15.2
126.0 5.0
127.0 4.5
128.0 4.2
129.0 7.7
130.0 1.9
133.0 4.1
134.0 4.4
135.0 7.0
136.0 3.4
137.0 12.9
138.0 11.5
139.0 9.4
140.0 2.4
141.0 6.3
142.0 6.0
143.0 7.3
144.0 2.7
147.0 3.5
148.0 3.4
149.0 4.9
150.0 3.6
151.0 9.5
152.0 14.8
153.0 6.8
154.0 1.7
155.0 15.4
156.0 3.2
157.0 10.5
158.0 1.8
161.0 2.3
162.0 1.1
163.0 2.8
164.0 3.4
165.0 6.7
166.0 11.0
167.0 4.5
168.0 1.4
169.0 5.3
170.0 1.1
171.0 3.6
172.0 1.2
175.0 1.7
177.0 1.5
178.0 2.0
179.0 4.3
180.0 19.5
181.0 5.4
182.0 1.4
183.0 3.5
185.0 3.5
186.0 1.1
189.0 1.0
192.0 1.3
193.0 3.1
194.0 5.4
195.0 2.0
197.0 1.3
199.0 3.3
200.0 1.1
207.0 2.8
208.0 3.3
209.0 1.6
211.0 1.3
213.0 4.1
214.0 1.6
220.0 7.0
221.0 5.0
222.0 24.3
223.0 6.3
224.0 1.0
227.0 2.9
228.0 1.8
235.0 2.8
236.0 6.7
237.0 3.1
239.0 2.3
241.0 2.4
242.0 1.3
246.0 4.5
247.0 2.0
250.0 1.3
255.0 1.4
256.0 1.0
262.0 2.4
263.0 4.0
264.0 62.6
265.0 31.8
266.0 5.4
267.0 2.5
282.0 2.3
283.0 1.2
284.0 6.2
285.0 1.7
298.0 1.6
308.0 4.2
309.0 1.6
310.0 20.9
311.0 9.9
312.0 3.0