Welcome to chemicalbook!
+1 (818) 612-2111
Inquriy
Try our best to find the right business for you.
Do not miss inquiry messages Please log in to view all inquiry messages.

Welcome back!

Back ChemicalBook Home>CAS DataBase List>111-49-9More Spectrum> Hexamethyleneimine(111-49-9) IR1

Hexamethyleneimine(111-49-9) IR1

Product NameHexamethyleneimine

CAS111-49-9

Molecular FormulaC6H13N

Molecular Weight99.17

InChIInChI=1S/C6H13N/c1-2-4-6-7-5-3-1/h7H,1-6H2

InChIKey ZSIQJIWKELUFRJ-UHFFFAOYSA-N

SmilesN1CCCCCC1


  • Mass

    MS-NW-3128          
    hexamethyleneimine
    C6H13N              (Mass of molecular ion:     99)
    

       Source Temperature: 280 °C
       Sample Temperature: 180 °C
       Reservoir, 75 eV
    

          15.0       3.4
          18.0       2.5
          26.0       1.7
          27.0      13.3
          28.0      21.3
          29.0       9.3
          30.0      70.8
          31.0       1.2
          38.0       1.4
          39.0      15.4
          40.0       3.2
          41.0      30.7
          42.0      29.2
          43.0      78.8
          44.0      41.0
          45.0       2.0
          51.0       1.1
          53.0       2.7
          54.0       2.9
          55.0      11.8
          56.0      66.9
          57.0      52.6
          58.0       2.6
          67.0       2.2
          68.0       6.6
          69.0       4.2
          70.0     100.0
          71.0       9.0
          81.0       1.2
          82.0       1.7
          84.0      13.8
          96.0       1.1
          97.0       1.4
          98.0      26.4
          99.0      64.7
         100.0       4.7
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C6 H13 N 0.05 ml : 0.5 ml CDCl3
    hexamethyleneimine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 2.84 B 1.68 C 1.61

         Hz     ppm     Int.
    

        254.44   2.842    277
        250.00   2.792    152
        249.19   2.783    155
        150.25   1.678    720
        144.63   1.615   1000
    

in CDCl3



liquid film





Hexamethyleneimine(111-49-9) IR1 Atlas of Related Products

×