3,5-DIMETHYL-1-HEXYN-3-OL(107-54-0) MS
Product Name3,5-DIMETHYL-1-HEXYN-3-OL
CAS107-54-0
Molecular FormulaC8H14O
Molecular Weight126.2
InChIInChI=1S/C8H14O/c1-5-8(4,9)6-7(2)3/h1,7,9H,6H2,2-4H3
InChIKey NECRQCBKTGZNMH-UHFFFAOYSA-N
SmilesC#CC(C)(O)CC(C)C
-
MassMS-NW-1044 3,5-dimethyl-1-hexyn-3-ol C8H14O (Mass of molecular ion: 126)
Source Temperature: 250 °C Sample Temperature: 130 °C Reservoir, 75 eV
15.0 1.7 18.0 1.1 27.0 5.9 28.0 1.1 29.0 5.8 39.0 8.0 40.0 2.2 41.0 13.2 42.0 1.7 43.0 24.2 45.0 1.0 50.0 1.0 51.0 2.5 53.0 2.1 55.0 3.6 56.0 1.4 57.0 5.0 58.0 1.3 65.0 1.6 66.0 2.8 67.0 2.4 68.0 3.5 69.0 100.0 70.0 7.1 71.0 1.3 77.0 3.0 83.0 1.2 84.0 6.5 91.0 2.0 93.0 3.8 111.0 10.3
in CDCl3
CCl4 solution
liquid film
4880 A,200 M,liquid
