4-METHYL-2-HEXANOL(2313-61-3) MS
Product Name4-METHYL-2-HEXANOL
CAS2313-61-3
Molecular FormulaC7H16O
Molecular Weight116.2
InChIInChI=1S/C7H16O/c1-4-6(2)5-7(3)8/h6-8H,4-5H2,1-3H3
InChIKey KZUBXUKRWLMPIO-UHFFFAOYSA-N
SmilesCC(O)CC(C)CC
-
MassMS-IW-3565 4-methyl-2-hexanol C7H16O (Mass of molecular ion: 116)
Source Temperature: 220 °C Sample Temperature: 160 °C Reservoir, 75 eV
15.0 1.0 18.0 1.0 19.0 1.0 27.0 9.2 28.0 3.3 29.0 14.4 31.0 8.4 39.0 7.1 40.0 1.2 41.0 27.2 42.0 8.1 43.0 22.7 44.0 7.0 45.0 100.0 46.0 3.3 53.0 1.7 55.0 14.2 56.0 23.7 57.0 31.0 58.0 11.1 59.0 41.4 60.0 1.5 69.0 18.0 70.0 16.0 71.0 10.7 72.0 1.9 83.0 17.1 84.0 1.2 87.0 7.3 98.0 5.6 101.0 5.5
in CDCl3
liquid film
