6700-34-1

氢溴酸右美沙芬(6700-34-1)质谱(MS)

分子式:C18H28BrNO2

分子量: 370.33

InChI:InChI=1/C18H25NO.BrH.H2O/c1-19-10-9-18-8-4-3-5-15(18)17(19)11-13-6-7-14(20-2)12-16(13)18;;/h6-7,12,15,17H,3-5,8-11H2,1-2H3;1H;1H2/t15-,17+,18+;;/s3

InChIKey: STTADZBLEUMJRG-NULMGNIUNA-N

Smiles:O(C1C=CC2C[C@]3([H])N(C)CC[C@]4(CCCC[C@@]43[H])C=2C=1)C.Br.O |&1:6,12,17,r|

IR1

IR2

Mass

MS-IW-3588          
dextromethorphan hydrobromide
C18H25NO HBr H2O    (Mass of molecular ion:    271)

   Source Temperature: 170 °C
   Sample Temperature: 120 °C
   Direct, 75 eV

      30.0       7.5
      31.0      13.7
      39.0       1.4
      41.0       3.2
      42.0      10.3
      43.0       1.3
      44.0       8.5
      51.0       1.1
      53.0       1.2
      55.0       2.2
      56.0       1.1
      57.0       1.5
      58.0       6.3
      59.0      89.7
      60.0       6.1
      65.0       1.4
      67.0       1.9
      70.0       3.6
      77.0       3.1
      78.0       1.2
      79.0       6.2
      80.0      16.6
      81.0       6.1
      82.0      16.3
      83.0       1.6
      91.0       4.0
      94.0       2.4
      95.0       1.4
      96.0       1.5
     102.0       1.3
     103.0       1.5
     105.0       1.3
     106.0       1.0
     106.5       1.1
     107.0       1.8
     108.0       2.1
     113.5       1.3
     114.0       1.2
     115.0       7.4
     116.0       2.1
     117.0       1.5
     120.0       1.2
     121.0       4.2
     122.0       2.9
     123.0       2.3
     124.0       1.2
     127.0       2.9
     128.0       8.4
     129.0       4.8
     130.0       1.3
     131.0       2.0
     134.0       1.3
     135.0       4.2
     135.5       5.7
     136.0       2.7
     139.0       1.1
     141.0       5.5
     142.0       2.2
     143.0       1.9
     144.0       2.9
     145.0       2.8
     146.0       3.4
     147.0       3.0
     148.0       5.2
     149.0       1.2
     150.0      50.5
     151.0       6.2
     152.0       2.2
     153.0       2.9
     154.0       1.9
     155.0       2.1
     156.0       1.4
     157.0       2.4
     158.0       3.3
     159.0       4.8
     160.0       3.0
     161.0       4.0
     162.0       5.6
     163.0       1.1
     165.0       1.9
     166.0       1.0
     167.0       1.4
     168.0       1.0
     169.0       1.8
     170.0       1.9
     171.0      18.8
     172.0       8.3
     173.0       2.9
     174.0       7.7
     175.0       4.5
     176.0       1.7
     181.0       1.5
     182.0       1.1
     183.0       2.1
     184.0       3.8
     185.0       4.5
     186.0       2.3
     187.0       1.1
     188.0       1.9
     197.0       2.2
     198.0       2.8
     199.0       2.6
     200.0       2.0
     201.0       1.1
     202.0       2.1
     203.0      13.7
     204.0       2.1
     211.0       1.4
     212.0      17.5
     213.0      15.4
     214.0      36.5
     215.0       6.7
     216.0       1.3
     226.0       1.0
     227.0       1.6
     228.0       5.4
     229.0       1.7
     240.0       1.5
     242.0       6.9
     243.0       1.9
     256.0       7.6
     257.0       1.7
     269.0       1.8
     270.0      48.4
     271.0     100.0
     272.0      20.0
     273.0       2.2
     283.0       1.4

KBr disc

nujol mull

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