1,3-金剛烷二乙酸(17768-28-4)紅外圖譜(IR2)
InChI:InChI=1S/C14H20O4/c15-11(16)6-13-2-9-1-10(4-13)5-14(3-9,8-13)7-12(17)18/h9-10H,1-8H2,(H,15,16)(H,17,18)
InChIKey: UTENGZNBNPABQE-UHFFFAOYSA-N
Smiles:C12(CC(O)=O)CC3CC(CC(CC(O)=O)(C3)C1)C2
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Mass
MS-NW-6342
1,3-adamantanediacetic acid
C14H20O4 (Mass of molecular ion: 252)
Source Temperature: 170 °C
Sample Temperature: 150 °C
Direct, 75 eV
15.0 1.0
27.0 10.0
28.0 1.6
29.0 8.5
31.0 2.2
39.0 18.6
40.0 3.7
41.0 24.1
42.0 4.0
43.0 5.9
45.0 9.6
50.0 1.0
51.0 4.1
52.0 3.1
53.0 12.0
54.0 2.0
55.0 10.1
56.0 1.4
57.0 1.9
59.0 1.1
60.0 9.1
63.0 2.2
65.0 8.8
66.0 2.8
67.0 8.3
68.0 1.0
69.0 1.8
71.0 1.6
77.0 20.7
78.0 5.7
79.0 21.7
80.0 3.2
81.0 4.7
82.0 1.2
83.0 2.0
91.0 62.2
92.0 16.1
93.0 17.8
94.0 2.0
95.0 3.4
96.0 1.2
103.0 3.8
104.0 9.0
105.0 30.5
106.0 6.0
107.0 7.7
108.0 1.2
109.0 2.3
115.0 3.5
116.0 2.0
117.0 6.3
118.0 2.0
119.0 8.5
120.0 1.1
121.0 2.7
125.0 1.0
128.0 1.3
129.0 2.0
130.0 1.3
131.0 7.5
132.0 2.3
133.0 50.1
134.0 5.3
135.0 1.3
136.0 1.1
137.0 4.7
145.0 3.4
146.0 4.3
147.0 14.4
148.0 3.0
149.0 5.3
150.0 3.8
151.0 4.8
152.0 1.1
153.0 2.4
162.0 4.7
163.0 1.7
175.0 8.5
176.0 1.4
190.0 2.5
191.0 1.0
193.0 100.0
194.0 13.7
195.0 1.5
206.0 46.8
207.0 6.6
210.0 2.0
234.0 26.6
235.0 4.5
252.0 10.8
253.0 1.5