148-51-6

4-脱氧吡哆醇盐酸盐(148-51-6)红外图谱(IR1)

产品名称:4-脱氧吡哆醇盐酸盐

CAS:148-51-6

分子式:C8H12ClNO2

分子量: 189.64

InChI:InChI=1S/C8H11NO2.ClH/c1-5-7(4-10)3-9-6(2)8(5)11;/h3,10-11H,4H2,1-2H3;1H

InChIKey: QZKKOQQIVLXUEI-UHFFFAOYSA-N

Smiles:C1(CO)=CN=C(C)C(O)=C1C.Cl

IR1

IR2

Mass

MS-NW-4900          
5-hydroxymethyl-2,4-dimethyl-3-pyridinol hydrochloride
C8H11NO2 HCl        (Mass of molecular ion:    153)

   Source Temperature: 200 °C
   Sample Temperature: 140 °C
   Direct, 75 eV

      15.0       2.7
      17.0       1.2
      18.0       5.9
      26.0       2.6
      27.0      14.0
      28.0       5.0
      29.0       5.2
      31.0       4.5
      35.0       5.7
      36.0      50.8
      37.0       1.8
      38.0      16.5
      39.0      14.7
      40.0       3.2
      41.0      10.2
      42.0      11.8
      43.0      11.5
      50.0       3.8
      51.0       8.3
      52.0       7.8
      53.0      10.7
      54.0       3.2
      55.0       7.7
      56.0       1.2
      63.0       2.0
      64.0       1.2
      65.0       6.4
      66.0      10.2
      67.0       8.7
      68.0       1.8
      69.0       1.8
      77.0       4.4
      78.0       1.6
      79.0       5.6
      80.0       6.8
      81.0       6.5
      82.0       4.4
      83.0       2.4
      91.0       2.2
      92.0       3.5
      93.0       2.3
      94.0       8.6
      95.0       3.2
      96.0       3.7
     106.0       7.0
     107.0      10.0
     108.0       5.8
     109.0       1.6
     110.0      11.1
     111.0       1.7
     122.0       8.0
     123.0       8.5
     124.0      57.8
     125.0       5.2
     134.0       2.2
     135.0      29.9
     136.0      14.0
     137.0       1.8
     138.0      12.2
     139.0       1.0
     150.0       1.8
     151.0       2.5
     152.0      31.0
     153.0     100.0
     154.0       9.3

KBr disc