1984-65-2

2,6-二氯苯甲醚(1984-65-2)質(zhì)譜(MS)

產(chǎn)品名稱(chēng):2,6-二氯苯甲醚

CAS:1984-65-2

分子式:C7H6Cl2O

分子量: 177.03

InChI:InChI=1S/C7H6Cl2O/c1-10-7-5(8)3-2-4-6(7)9/h2-4H,1H3

InChIKey: KZLMCDNAVVJKPX-UHFFFAOYSA-N

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

Mass

MS-NW-8964          
2,6-dichloroanisole
C7H6Cl2O            (Mass of molecular ion:    176)

   Source Temperature: 260 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      37.0       2.1
      38.0       1.9
      39.0       1.0
      49.0       1.6
      50.0       3.4
      51.0       2.4
      53.0       1.8
      61.0       3.5
      62.0       6.7
      63.0      16.3
      72.0       2.9
      73.0      13.7
      74.0       8.0
      75.0      15.1
      76.0       1.7
      77.0       3.3
      83.0       2.8
      84.0       3.2
      85.0       3.6
      86.0       1.2
      87.0       1.1
      97.0       5.1
      98.0       3.5
      99.0       2.0
     100.0       1.1
     107.0       3.2
     109.0       7.5
     110.0       2.3
     111.0       7.9
     112.0       1.7
     113.0       4.3
     126.0       3.6
     128.0       1.2
     133.0      58.1
     134.0       3.5
     135.0      37.7
     136.0       2.1
     137.0       6.1
     141.0       1.2
     145.0       3.0
     147.0       2.4
     161.0      77.6
     162.0       5.5
     163.0      50.2
     164.0       3.5
     165.0       8.2
     176.0     100.0
     177.0       8.0
     178.0      64.5
     179.0       5.1
     180.0      10.5

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₇ H₆ Cl₂ O	0.04 ml : 0.5 ml CDCl₃
2,6-dichloroanisole

    Assign.     Shift(ppm)

      A             7.27
      B             6.97
      C             3.90

     Hz     ppm     Int.

    656.69   7.333    118
    655.06   7.315    133
    648.25   7.239    225
    647.63   7.232    213
    630.94   7.045    129
    624.19   6.970     82
    621.81   6.943     58
    615.06   6.868     45
    349.06   3.898   1000

in CDCl3