1-PENTYNE(627-19-0) 13C NMR
Molecular FormulaC5H8
Molecular Weight68.12
InChIInChI=1S/C5H8/c1-3-5-4-2/h1H,4-5H2,2H3
InChIKey IBXNCJKFFQIKKY-UHFFFAOYSA-N
SmilesC#CCCC
-
Mass
MS-NW-2818
1-pentyne
C5H8 (Mass of molecular ion: 68)
Source Temperature: 280 °C
Sample Temperature: 180 °C
Reservoir, 75 eV
15.0 1.2
26.0 4.3
27.0 32.9
28.0 3.9
29.0 24.4
31.0 1.3
37.0 5.0
38.0 9.8
39.0 54.9
40.0 61.2
41.0 22.7
42.0 22.3
43.0 1.4
49.0 1.5
50.0 6.5
51.0 8.5
52.0 3.7
53.0 44.0
54.0 2.1
61.0 1.8
62.0 2.5
63.0 3.2
65.0 6.7
66.0 4.2
67.0 100.0
68.0 15.3