22612-89-1

1,1,3,3-四溴丙酮(22612-89-1)质谱(MS)

产品名称:1,1,3,3-四溴丙酮

CAS:22612-89-1

分子式:C3H2Br4O

分子量: 373.66

InChI:InChI=1S/C3H2Br4O/c4-2(5)1(8)3(6)7/h2-3H

InChIKey: SAMNBOHOBWEEEU-UHFFFAOYSA-N

Smiles:C(Br)(Br)C(=O)C(Br)Br

Mass

MS-IW-8620          
1,1,3,3-tetrabromoacetone
C3H2Br4O            (Mass of molecular ion:    370)

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

      25.0       1.9
      26.0       5.4
      28.0       1.0
      29.0       1.0
      37.0       1.0
      38.0       1.0
      41.0       1.4
      42.0       1.6
      53.0       1.3
      79.0       3.9
      80.0       3.0
      81.0       3.8
      82.0       3.0
      91.0       3.0
      92.0       7.2
      93.0       3.9
      94.0       7.1
     104.0       2.5
     105.0       5.5
     106.0       2.6
     107.0       5.4
     120.0      83.1
     121.0       6.5
     122.0      81.4
     123.0       6.3
     171.0      25.4
     172.0       1.4
     173.0      49.9
     174.0       1.1
     175.0      24.2
     184.0       1.2
     185.0       1.5
     186.0       2.2
     188.0       1.0
     198.0       3.9
     199.0      51.6
     200.0       8.7
     201.0     100.0
     202.0       6.0
     203.0      49.0
     204.0       1.1
     265.0       1.4
     267.0       1.4
     370.0       1.8
     372.0       7.1
     374.0      10.4
     376.0       6.8
     378.0       1.6

parameter in CDCl3

¹H NMR	300 MHz
C₃ H₂ Br₄ O	0.041 g : 0.5 ml CDCl₃
1,1,3,3-tetrabromoacetone

    Parameter     ppm  Hz

      D(A)         7.270

     Hz     ppm     Int.

   2181.00   7.270   1000

in CDCl3

KBr disk

nujol mull

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