環(huán)己基乙酸(5292-21-7)紅外圖譜(IR3)
InChI:InChI=1S/C8H14O2/c9-8(10)6-7-4-2-1-3-5-7/h7H,1-6H2,(H,9,10)
InChIKey: LJOODBDWMQKMFB-UHFFFAOYSA-N
Smiles:C1(CC(O)=O)CCCCC1
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Mass
MS-NW-4270
cyclohexylacetic acid
C8H14O2 (Mass of molecular ion: 142)
Source Temperature: 250 °C
Sample Temperature: 180 °C
Reservoir, 75 eV
18.0 1.8
26.0 1.0
27.0 12.5
28.0 2.8
29.0 9.7
31.0 1.0
39.0 15.3
40.0 2.8
41.0 35.2
42.0 4.1
43.0 5.9
45.0 4.1
51.0 1.6
53.0 6.6
54.0 18.4
55.0 57.2
56.0 4.2
57.0 2.3
60.0 100.0
61.0 54.1
62.0 2.0
65.0 1.2
66.0 1.0
67.0 38.8
68.0 4.5
69.0 1.9
70.0 1.0
71.0 1.5
73.0 2.1
77.0 1.2
79.0 3.0
80.0 2.7
81.0 11.6
82.0 62.2
83.0 69.7
84.0 4.4
85.0 1.1
95.0 1.7
97.0 1.1
99.0 5.0
124.0 1.3
142.0 3.3