2,4-Dimethyl-3-pentanol(600-36-2) IR1

Product Name2,4-Dimethyl-3-pentanol

CAS 600-36-2

Molecular FormulaC7H16O

Molecular Weight116.2

InChIInChI=1S/C7H16O/c1-5(2)7(8)6(3)4/h5-8H,1-4H3

InChIKey BAYAKMPRFGNNFW-UHFFFAOYSA-N

SmilesCC(C)C(O)C(C)C

Request For Quotation

Mass

MS-NW-0962          
2,4-dimethyl-3-pentanol
C7H16O              (Mass of molecular ion:    116)

   Source Temperature: 280 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      27.0       8.0
      28.0       1.1
      29.0       5.1
      31.0       6.2
      39.0       6.1
      41.0      11.3
      42.0       1.5
      43.0      23.0
      45.0      10.9
      53.0       1.0
      55.0      43.8
      56.0       4.6
      57.0       5.2
      59.0       1.7
      71.0       1.2
      72.0       8.5
      73.0     100.0
      74.0       4.5
      83.0       1.8

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₇ H₁₆ O	0.04 ml : 0.5 ml CDCl₃
2,4-dimethyl-3-pentanol

    Assign.     Shift(ppm)

      A             3.005
      B             1.73
      C             1.474
      D             0.923

     Hz     ppm     Int.

    275.00   3.071     41
    269.31   3.008     85
    263.56   2.943     46
    168.00   1.876     24
    166.88   1.864     30
    161.00   1.798     40
    160.25   1.790     39
    154.63   1.727     45
    153.44   1.714     41
    147.50   1.647     45
    146.94   1.641     37
    141.25   1.578     25
    132.00   1.474    453
     85.38   0.954   1000
     81.31   0.908     28
     78.88   0.881    709

in CDCl3