(S)-(+)-5-METHYL-1-HEPTANOL(57803-73-3) Raman
Molecular FormulaC8H18O
Molecular Weight130.23
InChIInChI=1S/C8H18O/c1-3-8(2)6-4-5-7-9/h8-9H,3-7H2,1-2H3/t8-/m0/s1
InChIKey KFARNLMRENFOHE-QMMMGPOBSA-N
SmilesC(O)CCC[C@@H](C)CC
-
Mass
MS-IW-0892
(S)-(+)-5-methyl-1-heptanol
C8H18O (Mass of molecular ion: 130)
Source Temperature: 220 °C
Sample Temperature: 150 °C
Reservoir, 75 eV
27.0 5.3
28.0 2.1
29.0 16.8
31.0 7.6
39.0 4.6
40.0 1.1
41.0 40.2
42.0 7.8
43.0 20.4
44.0 1.6
45.0 2.3
53.0 1.6
54.0 1.7
55.0 100.0
56.0 50.1
57.0 33.5
58.0 1.5
67.0 4.1
68.0 1.1
69.0 21.3
70.0 46.5
71.0 6.9
73.0 10.3
74.0 1.2
81.0 1.2
82.0 8.3
83.0 80.1
84.0 22.7
85.0 1.7
97.0 5.4