2,2-双(4-羧基苯基)六氟丙烷(1171-47-7)红外图谱(IR2)
分子式:C17H10F6O4
分子量: 392.25
InChI:InChI=1S/C17H10F6O4/c18-16(19,20)15(17(21,22)23,11-5-1-9(2-6-11)13(24)25)12-7-3-10(4-8-12)14(26)27/h1-8H,(H,24,25)(H,26,27)
InChIKey: PHQYMDAUTAXXFZ-UHFFFAOYSA-N
Smiles:C(C1=CC=C(C=C1)C(O)=O)(C1=CC=C(C=C1)C(O)=O)(C(F)(F)F)C(F)(F)F
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Mass
MS-IW-1789
4,4'-(2,2,2-trifluoro-1-(trifluoromethyl)ethylidene)dibenzoic acid
C17H10F6O4 (Mass of molecular ion: 392)
Source Temperature: 150 °C
Sample Temperature: 120 °C
Direct, 75 eV
39.0 1.2
44.0 1.1
45.0 3.0
50.0 2.0
51.0 1.8
63.0 1.3
65.0 1.6
69.0 1.0
74.0 1.0
75.0 1.8
76.0 1.9
81.0 1.0
82.0 1.6
87.0 1.0
91.0 1.4
91.5 2.1
96.0 2.0
100.0 1.2
105.0 1.6
106.0 1.2
107.0 1.3
115.0 1.6
116.0 1.7
130.5 1.0
139.0 2.5
144.5 1.9
145.0 1.1
152.0 2.2
153.0 2.1
157.0 1.0
163.0 3.5
164.0 3.7
165.0 41.3
166.0 9.3
167.0 1.0
171.0 1.6
179.0 5.3
179.5 1.0
181.0 3.2
182.0 2.6
183.0 14.4
184.0 2.3
193.0 1.0
195.0 1.4
199.0 1.1
201.0 1.4
209.0 3.5
211.0 1.5
212.0 1.7
213.0 1.8
214.0 37.5
215.0 36.3
216.0 5.3
227.0 1.8
231.0 1.1
232.0 4.7
233.0 9.2
234.0 3.5
235.0 2.9
258.0 3.9
259.0 1.9
261.0 3.5
277.0 4.4
278.0 2.2
279.0 1.6
283.0 6.6
284.0 1.1
295.0 1.5
303.0 14.1
304.0 3.0
305.0 3.3
306.0 1.5
323.0 17.5
324.0 3.2
327.0 1.1
329.0 2.4
346.0 1.7
347.0 30.6
348.0 7.3
349.0 1.0
361.0 1.0
373.0 4.7
374.0 1.2
375.0 9.1
376.0 1.8
391.0 27.3
392.0 100.0
393.0 18.9
394.0 2.5