4-甲基-5-羥乙基噻唑(137-00-8)核磁圖(¹HNMR)

產(chǎn)品名稱:4-甲基-5-羥乙基噻唑

CAS:137-00-8

分子式:C6H9NOS

分子量: 143.21

InChI:InChI=1S/C6H9NOS/c1-5-6(2-3-8)9-4-7-5/h4,8H,2-3H2,1H3

InChIKey: BKAWJIRCKVUVED-UHFFFAOYSA-N

Smiles:S1C(CCO)=C(C)N=C1

Mass

MS-NW-4265          
2-(4-methyl-5-thiazolyl)ethanol
C6H9NOS             (Mass of molecular ion:    143)

   Source Temperature: 260 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      26.0       1.5
      27.0       6.2
      28.0       2.8
      29.0       2.0
      31.0       7.5
      39.0       5.3
      41.0       5.9
      42.0       2.4
      43.0       1.8
      45.0      22.5
      47.0       1.5
      50.0       1.2
      51.0       3.1
      52.0       1.9
      53.0       5.4
      54.0       1.5
      55.0       2.7
      58.0       3.8
      59.0       7.5
      68.0       2.6
      69.0       3.0
      70.0       1.4
      71.0       6.9
      72.0       4.4
      84.0       1.2
      85.0      27.8
      86.0       4.8
      87.0       1.8
      97.0       1.2
      98.0       1.8
      99.0       1.1
     112.0     100.0
     113.0      38.0
     114.0       7.1
     115.0       1.9
     125.0       1.7
     143.0      32.4
     144.0       2.6
     145.0       1.7

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₆ H₉ N O S	0.04 ml : 0.5 ml CDCl₃
2-(4-methyl-5-thiazolyl)ethanol

    Assign.     Shift(ppm)

      A             8.515
      B             3.805
      C             3.51
      D             2.997
      E             2.377

     Hz     ppm     Int.

    762.63   8.516    385
    348.06   3.887    123
    347.56   3.881    119
    341.56   3.814    263
    341.06   3.809    368
    335.13   3.742    193
    314.56   3.513    226
    274.25   3.063    137
    267.88   2.992    230
    261.50   2.920     96
    213.06   2.379   1000

in CDCl3