1,7-庚二醇(629-30-1)紅外圖譜(IR1)
InChI:InChI=1S/C7H16O2/c8-6-4-2-1-3-5-7-9/h8-9H,1-7H2
InChIKey: SXCBDZAEHILGLM-UHFFFAOYSA-N
Smiles:C(O)CCCCCCO
-
Mass
MS-NW-4191
1,7-heptanediol
C7H16O2 (Mass of molecular ion: 132)
Source Temperature: 230 °C
Sample Temperature: 180 °C
Reservoir, 75 eV
15.0 1.8
18.0 2.0
19.0 2.0
26.0 1.2
27.0 15.6
28.0 5.2
29.0 21.4
30.0 1.0
31.0 51.8
32.0 1.1
39.0 11.8
40.0 3.4
41.0 59.3
42.0 32.7
43.0 30.5
44.0 17.7
45.0 8.7
49.0 1.6
53.0 6.1
54.0 23.3
55.0 73.7
56.0 49.8
57.0 24.7
58.0 4.4
59.0 1.3
66.0 1.8
67.0 36.7
68.0 100.0
69.0 20.8
70.0 5.0
71.0 24.4
72.0 2.5
73.0 2.7
79.0 1.6
81.0 32.9
82.0 3.1
83.0 3.8
84.0 24.5
85.0 4.6
86.0 2.6
95.0 3.8
96.0 3.5
97.0 1.4
102.0 1.0
173.0 1.1