90282-99-8

1-氯-2,3-二甲氧基苯(90282-99-8)核磁圖(¹³CNMR)

產(chǎn)品名稱:1-氯-2,3-二甲氧基苯

CAS:90282-99-8

分子式:C8H9ClO2

分子量: 172.61

InChI:InChI=1S/C8H9ClO2/c1-10-7-5-3-4-6(9)8(7)11-2/h3-5H,1-2H3

InChIKey: JVCXXMPHTZGGNV-UHFFFAOYSA-N

Smiles:C1(Cl)=CC=CC(OC)=C1OC

¹HNMR

¹³CNMR

IR1

Mass

MS-IW-6151          
1-chloro-2,3-dimethoxybenzene
C8H9ClO2            (Mass of molecular ion:    172)

   Source Temperature: 200 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      15.0       1.6
      28.0       1.1
      29.0       1.0
      37.0       1.2
      38.0       1.0
      39.0       2.4
      43.0       1.1
      49.0       1.0
      50.0       5.1
      51.0      14.3
      52.0       1.0
      53.0       3.5
      55.0       2.0
      61.0       1.3
      62.0       2.7
      63.0       8.8
      64.0       1.3
      65.0      19.1
      66.0       1.8
      73.0       2.2
      74.0       1.5
      75.0       5.5
      76.0       1.2
      77.0       5.5
      79.0      12.3
      85.0       1.7
      86.0       5.2
      87.0       1.0
      88.0       1.7
      91.0       2.7
      92.0       1.3
      93.0      32.5
      94.0      17.8
      95.0       1.5
      98.0       1.5
      99.0       7.8
     100.0       1.0
     101.0       3.2
     107.0       4.0
     111.0       7.2
     113.0       3.1
     114.0      10.6
     116.0       3.4
     126.0       3.2
     128.0       1.3
     129.0      21.4
     130.0       1.5
     131.0       6.9
     155.0       1.7
     156.0       2.2
     157.0      67.0
     158.0       6.0
     159.0      21.7
     160.0       1.7
     172.0     100.0
     173.0       9.0
     174.0      32.9
     175.0       2.9

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₈ H₉ Cl O₂	0.03 ml : 0.5 ml CDCl₃
1-chloro-2,3-dimethoxybenzene

    Assign.     Shift(ppm)

      A             6.97
      B             6.95
      C             6.809
      D     *1      3.862
      E     *1      3.853

     Hz     ppm     Int.

   2793.58   6.991     34
   2785.52   6.970    190
   2782.23   6.962    207
   2779.05   6.954    438
   2774.05   6.942     49
   2725.71   6.821    115
   2722.29   6.812     98
   2719.24   6.805     89
   2715.94   6.796     86
   1544.07   3.864   1000
   1543.70   3.863    915
   1539.79   3.853    842

in CDCl3