三油酸甘油酯(122-32-7)紅外圖譜(IR2)
分子式:C57H104O6
分子量: 885.43
InChI:InChI=1S/C57H104O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h25-30,54H,4-24,31-53H2,1-3H3/b28-25-,29-26-,30-27-
InChIKey: PHYFQTYBJUILEZ-IUPFWZBJSA-N
Smiles:C(OC(=O)CCCCCCC/C=C\CCCCCCCC)C(OC(=O)CCCCCCC/C=C\CCCCCCCC)COC(=O)CCCCCCC/C=C\CCCCCCCC
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Mass
MS-NW-9071
1,2,3-propanetriyl trioleate
C57H104O6 (Mass of molecular ion: 884)
Source Temperature: 250 °C
Sample Temperature: 240 °C
Direct, 75 eV
18.0 1.7
26.0 1.1
27.0 7.4
28.0 3.9
29.0 12.3
39.0 7.1
40.0 1.5
41.0 36.4
42.0 8.0
43.0 34.2
44.0 2.5
45.0 1.7
53.0 4.1
54.0 14.0
55.0 64.6
56.0 16.7
57.0 36.7
58.0 2.4
59.0 1.2
60.0 3.7
65.0 1.3
66.0 1.9
67.0 35.5
68.0 15.3
69.0 56.9
70.0 15.1
71.0 17.7
72.0 1.2
73.0 5.1
77.0 1.9
78.0 1.1
79.0 9.5
80.0 7.1
81.0 39.4
82.0 21.3
83.0 53.8
84.0 17.7
85.0 12.2
86.0 1.0
87.0 2.3
91.0 4.1
92.0 1.7
93.0 9.2
94.0 6.7
95.0 36.7
96.0 21.0
97.0 42.3
98.0 31.5
99.0 7.3
100.0 3.0
101.0 3.0
105.0 3.3
107.0 7.8
108.0 5.9
109.0 23.0
110.0 13.5
111.0 24.1
112.0 12.6
113.0 6.1
114.0 3.1
116.0 3.4
117.0 2.5
119.0 3.9
120.0 2.0
121.0 13.7
122.0 4.6
123.0 15.3
124.0 9.6
125.0 11.4
126.0 5.4
127.0 6.3
129.0 9.5
131.0 1.3
133.0 5.0
134.0 3.7
135.0 13.4
136.0 4.6
137.0 13.4
138.0 8.0
139.0 7.4
140.0 2.7
141.0 5.1
143.0 2.1
145.0 1.0
147.0 4.4
148.0 3.2
149.0 8.5
150.0 4.4
151.0 12.9
152.0 8.6
153.0 6.7
154.0 2.3
155.0 5.5
157.0 2.2
158.0 3.4
161.0 3.2
162.0 1.7
163.0 5.3
164.0 4.8
165.0 9.6
166.0 6.6
167.0 5.3
168.0 2.1
169.0 4.1
171.0 6.9
172.0 2.4
175.0 2.4
177.0 3.4
178.0 3.5
179.0 5.9
180.0 4.5
181.0 3.9
182.0 1.7
183.0 3.0
185.0 6.1
186.0 1.5
187.0 1.3
189.0 1.8
191.0 2.4
192.0 1.6
193.0 3.8
194.0 2.4
195.0 2.5
196.0 1.2
197.0 1.6
199.0 2.4
201.0 1.2
203.0 1.2
205.0 1.7
206.0 1.2
207.0 4.0
208.0 2.4
209.0 2.5
210.0 1.1
211.0 1.5
213.0 3.0
214.0 1.5
215.0 1.0
218.0 1.1
219.0 1.3
220.0 6.7
221.0 5.7
222.0 4.0
223.0 2.0
225.0 1.4
226.0 1.0
227.0 5.3
228.0 1.3
229.0 1.6
233.0 1.6
234.0 2.4
235.0 3.1
236.0 3.2
237.0 2.1
238.0 1.0
239.0 2.5
240.0 2.0
241.0 3.8
242.0 2.3
243.0 1.8
245.0 4.2
246.0 8.7
247.0 8.0
248.0 2.4
249.0 1.7
250.0 1.0
251.0 1.2
253.0 1.9
254.0 1.2
255.0 2.1
256.0 1.7
259.0 1.1
260.0 3.3
261.0 3.9
262.0 33.7
263.0 17.3
264.0 62.7
265.0 58.9
266.0 11.1
267.0 4.6
268.0 1.1
269.0 1.3
275.0 1.2
276.0 2.1
277.0 2.7
278.0 3.5
279.0 6.9
280.0 5.1
281.0 5.1
282.0 3.2
283.0 2.1
284.0 2.0
293.0 1.0
295.0 2.3
297.0 1.7
307.0 1.0
309.0 1.3
311.0 1.1
313.0 1.1
318.0 1.0
320.0 2.0
321.0 2.3
322.0 1.9
323.0 3.9
324.0 1.1
325.0 2.1
335.0 1.7
336.0 3.3
337.0 9.3
338.0 22.1
339.0 59.5
340.0 13.8
341.0 7.3
342.0 1.5
351.0 1.5
352.0 1.1
353.0 2.8
354.0 1.2
355.0 2.4
356.0 1.2
357.0 1.2
365.0 1.1
367.0 2.1
380.0 3.4
381.0 3.4
382.0 1.3
393.0 21.3
394.0 6.0
395.0 2.6
407.0 2.1
409.0 1.1
419.0 1.1
421.0 1.3
433.0 1.0
435.0 2.5
436.0 2.1
437.0 1.1
447.0 2.6
448.0 1.4
449.0 14.6
450.0 5.6
451.0 3.2
452.0 1.0
461.0 1.0
463.0 2.8
464.0 2.2
465.0 2.8
466.0 1.0
475.0 1.3
476.0 1.3
477.0 2.4
478.0 1.9
479.0 2.1
489.0 1.4
490.0 1.4
491.0 2.4
492.0 2.6
493.0 3.8
494.0 1.6
495.0 1.0
503.0 2.8
504.0 2.3
505.0 4.2
506.0 5.7
507.0 3.2
508.0 1.5
509.0 1.2
517.0 1.8
518.0 1.7
519.0 2.4
520.0 3.6
521.0 1.9
529.0 2.0
531.0 1.1
534.0 1.0
559.0 1.8
576.0 1.3
577.0 2.4
578.0 1.0
589.0 1.6
590.0 1.3
591.0 1.5
600.0 7.1
602.0 69.9
603.0 100.0
604.0 41.4
605.0 18.3
606.0 2.7
616.0 3.7
617.0 5.1
618.0 4.5
619.0 5.8
620.0 3.0
621.0 1.1
866.0 1.7
884.0 3.7