500-66-3

3,5-二羟基戊苯(500-66-3)红外图谱(IR1)

产品名称:3,5-二羟基戊苯

CAS:500-66-3

分子式:C11H16O2

分子量: 180.24

Mass

MS-NW-8823          
5-pentylresorcinol
C11H16O2            (Mass of molecular ion:    180)

   Source Temperature: 190 °C
   Sample Temperature: 110 °C
   Direct, 75 eV

      27.0       3.9
      29.0       4.7
      39.0       4.0
      41.0       8.1
      43.0       3.2
      51.0       2.0
      53.0       2.7
      55.0       5.5
      65.0       3.1
      66.0       1.7
      67.0       4.7
      69.0       6.8
      77.0       4.3
      78.0       1.3
      79.0       2.1
      81.0       2.4
      91.0       2.3
      94.0       1.3
      95.0       4.3
      96.0       1.6
     106.0       1.2
     107.0       2.2
     109.0       1.4
     110.0       1.5
     111.0       1.3
     123.0      24.0
     124.0     100.0
     125.0       8.2
     136.0       1.3
     137.0      10.0
     138.0      12.7
     139.0       1.7
     151.0       1.7
     152.0       1.0
     180.0      24.7
     181.0       3.7

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₁₁ H₁₆ O₂	0.05 ml : 0.5 ml CDCl₃
5-pentylresorcinol

    Assign.     Shift(ppm)

      A             7.
      B             6.252
      C             6.175
      D             2.360
      E             1.458
      F             1.25
      G             1.22
      J             0.830
     
     J(B,C)=2.2HZ

     Hz     ppm     Int.

   2499.76   6.255    579
   2497.56   6.250    610
   2469.73   6.180    169
   2467.90   6.176    222
    951.05   2.380    192
    943.48   2.361    242
    935.42   2.341    194
    597.90   1.497     62
    590.33   1.478    132
    582.89   1.459    172
    576.90   1.444    107
    575.20   1.440    131
    567.63   1.421     59
    518.43   1.298     43
    515.63   1.291     55
    511.35   1.280     81
    508.42   1.273     97
    502.20   1.257    157
    495.97   1.242    253
    495.00   1.239    259
    491.94   1.231    347
    489.26   1.225    302
    488.16   1.222    293
    484.99   1.214    244
    480.71   1.203    174
    476.56   1.193    107
    474.49   1.188     77
    473.14   1.184     76
    471.80   1.181     61
    468.02   1.172     40
    464.97   1.164     32
    351.07   0.879     37
    347.41   0.870     39
    344.12   0.862     59
    343.26   0.859     64
    337.89   0.846    443
    331.05   0.829   1000
    323.97   0.811    407

in CDCl3