異戊酸正辛酯(7786-58-5)紅外圖譜(IR1)
InChI:InChI=1S/C13H26O2/c1-4-5-6-7-8-9-10-15-13(14)11-12(2)3/h12H,4-11H2,1-3H3
InChIKey: FUBGRVHGQADOJI-UHFFFAOYSA-N
Smiles:C(OCCCCCCCC)(=O)CC(C)C
-
Mass
MS-NW-0700
octyl isovalerate
C13H26O2 (Mass of molecular ion: 214)
Source Temperature: 200 °C
Sample Temperature: 150 °C
Reservoir, 75 eV
18.0 3.2
27.0 11.9
28.0 5.0
29.0 24.7
31.0 1.0
32.0 1.2
39.0 9.7
40.0 1.9
41.0 46.2
42.0 19.9
43.0 45.0
44.0 1.6
45.0 1.7
53.0 2.3
54.0 3.4
55.0 31.0
56.0 42.1
57.0 86.1
58.0 5.9
59.0 4.9
60.0 10.7
61.0 21.2
67.0 2.8
68.0 8.5
69.0 26.1
70.0 49.4
71.0 29.3
72.0 1.7
81.0 1.0
82.0 10.1
83.0 34.8
84.0 39.8
85.0 76.0
86.0 4.4
87.0 12.6
97.0 4.2
100.0 1.3
101.0 1.6
102.0 8.7
103.0 100.0
104.0 5.6
111.0 1.2
112.0 54.6
113.0 6.0
115.0 1.8
129.0 1.1
143.0 1.1
157.0 2.1
158.0 2.3