2-異丙氧基苯酚(4812-20-8)核磁圖(¹³CNMR)

產(chǎn)品名稱:2-異丙氧基苯酚

CAS:4812-20-8

分子式:C9H12O2

分子量: 152.19

InChI:InChI=1S/C9H12O2/c1-7(2)11-9-6-4-3-5-8(9)10/h3-7,10H,1-2H3

InChIKey: ZNCUUYCDKVNVJH-UHFFFAOYSA-N

Smiles:C1(O)=CC=CC=C1OC(C)C

¹HNMR

¹³CNMR

IR1

Mass

MS-IW-1267          
o-isopropoxyphenol
C9H12O2             (Mass of molecular ion:    152)

   Source Temperature: 230 °C
   Sample Temperature: 160 °C
   Reservoir, 75 eV

      27.0       3.3
      39.0       2.9
      41.0       3.7
      43.0       5.2
      51.0       1.0
      52.0       1.3
      53.0       2.1
      54.0       1.0
      63.0       1.9
      64.0       5.3
      65.0       1.5
      81.0       4.0
      82.0       2.8
      92.0       4.0
     109.0       2.8
     110.0     100.0
     111.0       7.6
     152.0      18.3
     153.0       1.8

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₉ H₁₂ O₂	0.05 ml : 0.5 ml CDCl₃
o-isopropoxyphenol

    Assign.     Shift(ppm)

      A             6.929
      B             6.84
      C             6.82
      D             6.80
      E             5.83
      F             4.528
      G             1.321

     Hz     ppm     Int.

   2775.02   6.944    124
   2773.07   6.939     87
   2770.87   6.934     38
   2767.46   6.925    156
   2767.09   6.924    152
   2765.26   6.920    123
   2764.28   6.917     79
   2738.65   6.853     76
   2737.06   6.849     56
   2735.11   6.844    113
   2732.30   6.837     34
   2730.10   6.832    255
   2728.88   6.829    243
   2727.91   6.826    147
   2723.51   6.815    161
   2722.05   6.812    210
   2719.97   6.806    199
   2716.80   6.798     60
   2715.70   6.796     49
   2712.89   6.789    103
   2707.15   6.774     43
   2705.44   6.770     36
   2330.44   5.832    462
   1822.27   4.560     43
   1816.16   4.545    104
   1810.06   4.530    137
   1803.96   4.514    106
   1797.97   4.499     45
    531.13   1.329   1000
    524.90   1.314    965

in CDCl3