罌粟堿(58-74-2)質(zhì)譜(MS)

產(chǎn)品名稱:罌粟堿

分子式:C20H21NO4

分子量: 339.39

InChI:InChI=1S/C20H21NO4/c1-22-17-6-5-13(10-18(17)23-2)9-16-15-12-20(25-4)19(24-3)11-14(15)7-8-21-16/h5-8,10-12H,9H2,1-4H3

InChIKey: XQYZDYMELSJDRZ-UHFFFAOYSA-N

Smiles:C1(CC2=CC=C(OC)C(OC)=C2)C2=C(C=C(OC)C(OC)=C2)C=CN=1

IR1

IR2

Mass

MS-IW-2517          
6,7-dimethoxy-1-veratrylisoquinoline
C20H21NO4           (Mass of molecular ion:    339)

   Source Temperature: 220 °C
   Sample Temperature: 190 °C
   Direct, 75 eV

      28.0       1.0
      51.0       1.4
      63.0       1.2
      65.0       1.2
      75.0       1.1
      76.0       1.4
      77.0       1.9
      78.0       1.1
      83.5       1.6
      89.0       2.4
      89.5       1.6
      90.0       1.7
      91.0       1.2
      95.5       3.0
      96.0       1.1
     102.0       2.2
     103.5       1.9
     104.0       1.1
     105.0       1.3
     106.0       1.5
     107.0       2.2
     110.0       1.2
     110.5       1.3
     111.0       1.3
     117.0       1.2
     117.5       2.0
     118.0       1.5
     118.5       1.1
     119.0       1.4
     123.5       1.1
     124.5       1.0
     125.0       1.7
     126.5       2.3
     127.0       1.1
     131.5       1.1
     132.0       1.4
     132.5       4.3
     133.0       1.4
     138.5       2.1
     139.0       2.0
     140.0       1.5
     140.5       4.4
     141.0       1.6
     146.0       1.3
     146.5       3.8
     147.0       1.2
     151.0       5.0
     152.0       1.4
     153.5       1.4
     154.0      14.4
     154.5       3.8
     162.0       1.2
     166.0       1.5
     167.0       1.7
     169.5       7.4
     170.0       2.0
     178.0       2.1
     179.0       1.5
     180.0       1.5
     188.0       1.0
     190.0       1.2
     191.0       2.5
     192.0       1.7
     194.0       1.7
     195.0       1.7
     202.0       2.0
     203.0       1.1
     204.0       1.5
     206.0       1.3
     207.0       2.5
     208.0       2.3
     209.0       1.8
     210.0       2.4
     219.0       1.2
     220.0       3.0
     221.0       1.8
     222.0       2.1
     223.0       1.6
     233.0       1.2
     234.0       1.8
     235.0       2.0
     236.0       2.8
     237.0       1.9
     238.0       3.2
     248.0       2.2
     249.0       2.4
     250.0       4.2
     251.0       1.4
     252.0       2.3
     253.0       3.3
     262.0       2.1
     263.0       2.3
     264.0       4.7
     265.0       3.1
     266.0       5.9
     267.0       1.2
     276.0       1.1
     277.0       2.2
     278.0       4.3
     279.0       2.8
     280.0       6.6
     281.0       3.8
     292.0       7.8
     293.0      12.9
     294.0       7.4
     295.0       1.8
     296.0       4.3
     306.0       1.6
     307.0       4.1
     308.0      21.2
     309.0       7.6
     310.0       2.8
     322.0      10.2
     323.0       6.0
     324.0     100.0
     325.0      21.6
     326.0       3.1
     338.0      97.0
     339.0      93.6
     340.0      19.3
     341.0       2.7

KBr disc

nujol mull

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