Butyl isovalerate(109-19-3) 13C NMR
Molecular FormulaC9H18O2
Molecular Weight158.24
InChIInChI=1S/C9H18O2/c1-4-5-6-11-9(10)7-8(2)3/h8H,4-7H2,1-3H3
InChIKey AYWJSCLAAPJZEF-UHFFFAOYSA-N
SmilesC(OCCCC)(=O)CC(C)C
-
Mass
MS-NW-0935
butyl isovalerate
C9H18O2 (Mass of molecular ion: 158)
Source Temperature: 280 °C
Sample Temperature: 150 °C
Reservoir, 75 eV
15.0 1.2
18.0 2.1
26.0 1.0
27.0 16.0
28.0 5.2
29.0 36.3
31.0 1.8
39.0 12.8
40.0 2.3
41.0 52.8
42.0 6.7
43.0 20.8
45.0 4.0
53.0 1.2
55.0 11.0
56.0 89.3
57.0 95.6
58.0 4.3
59.0 6.1
60.0 29.5
61.0 13.4
69.0 2.8
71.0 5.7
72.0 1.0
73.0 1.6
85.0 100.0
86.0 6.3
87.0 16.6
88.0 1.0
89.0 2.8
101.0 3.4
102.0 4.1
103.0 52.6
104.0 3.0
115.0 2.1
116.0 4.4