N-PENTYLCYCLOHEXANE(4292-92-6) ¹H NMR

Product NameN-PENTYLCYCLOHEXANE

CAS 4292-92-6

Molecular FormulaC11H22

Molecular Weight154.29

InChIInChI=1S/C11H22/c1-2-3-5-8-11-9-6-4-7-10-11/h11H,2-10H2,1H3

InChIKey HLTMUYBTNSVOFY-UHFFFAOYSA-N

SmilesC1(CCCCC)CCCCC1

Request For Quotation

Mass

MS-NW-5158          
pentylcyclohexane
C11H22              (Mass of molecular ion:    154)

   Source Temperature: 260 °C
   Sample Temperature: 190 °C
   Reservoir, 75 eV

      27.0       6.8
      29.0       9.8
      39.0       6.8
      40.0       1.0
      41.0      25.1
      42.0       5.1
      43.0       9.9
      53.0       2.9
      54.0       5.2
      55.0      60.6
      56.0       8.7
      57.0       3.6
      67.0      14.2
      68.0       3.4
      69.0      10.5
      70.0       7.8
      71.0       1.4
      81.0       2.3
      82.0      63.9
      83.0     100.0
      84.0       8.3
      97.0       5.1
      98.0       1.3
     111.0       1.1
     154.0      10.7
     155.0       1.3

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₁₁ H₂₂	0.05 ml : 0.5 ml CDCl₃
pentylcyclohexane

    Assign.     Shift(ppm)

      A             1.68
      B             1.25
      C             1.16
      D             0.880
      E             0.84

     Hz     ppm     Int.

    680.42   1.703    223
    670.53   1.678    282
    648.19   1.622     87
    515.14   1.289    267
    514.40   1.288    264
    513.06   1.284    262
    506.96   1.269    321
    501.46   1.255    379
    500.00   1.252    372
    496.34   1.242    272
    494.38   1.238    232
    491.82   1.231    227
    490.11   1.227    272
    477.66   1.196    242
    466.43   1.168    406
    358.52   0.898    452
    351.68   0.880   1000
    344.48   0.862    604
    334.35   0.837    161

in CDCl3