4-HEXEN-3-ONE(2497-21-4) 13C NMR
Product Name4-HEXEN-3-ONE
CAS2497-21-4
Molecular FormulaC6H10O
Molecular Weight98.14
InChIInChI=1S/C6H10O/c1-3-5-6(7)4-2/h3,5H,4H2,1-2H3
InChIKey FEWIGMWODIRUJM-UHFFFAOYSA-N
SmilesCCC(=O)C=CC
-
MassMS-NW-9559 4-hexen-3-one C6H10O (Mass of molecular ion: 98)
Source Temperature: 240 °C Sample Temperature: 150 °C Reservoir, 75 eV
27.0 4.8 28.0 1.4 29.0 7.5 38.0 1.4 39.0 14.3 40.0 1.8 41.0 44.6 42.0 2.1 43.0 1.0 55.0 1.2 57.0 4.8 68.0 1.0 69.0 100.0 70.0 5.4 83.0 4.2 98.0 13.6 99.0 1.8
in CDCl3
liquid film
4880 A,200 M,liquid
