3-METHYL-3-HEPTANOL(5582-82-1) IR1
Molecular FormulaC8H18O
Molecular Weight130.23
InChIInChI=1S/C8H18O/c1-4-6-7-8(3,9)5-2/h9H,4-7H2,1-3H3
InChIKey PQOSNJHBSNZITJ-UHFFFAOYSA-N
SmilesCCC(C)(O)CCCC
-
Mass
MS-IW-0627
3-methyl-3-heptanol
C8H18O (Mass of molecular ion: 130)
Source Temperature: 230 °C
Sample Temperature: 160 °C
Reservoir, 75 eV
18.0 1.4
27.0 5.6
28.0 1.1
29.0 7.5
31.0 3.4
39.0 3.8
41.0 15.3
42.0 3.0
43.0 17.3
45.0 22.1
53.0 1.5
55.0 56.9
56.0 4.1
57.0 10.5
58.0 1.7
59.0 13.0
69.0 4.1
70.0 11.3
71.0 4.1
72.0 1.6
73.0 100.0
74.0 4.7
83.0 16.5
84.0 1.7
97.0 2.4
101.0 33.5
102.0 2.3
112.0 4.0
113.0 1.4
115.0 10.6