1436-34-6

1，2-環(huán)氧已烷(1436-34-6)核磁圖(¹³CNMR)

產(chǎn)品名稱:1，2-環(huán)氧已烷

CAS:1436-34-6

分子式:C6H12O

分子量: 100.16

InChI:InChI=1S/C6H12O/c1-2-3-4-6-5-7-6/h6H,2-5H2,1H3

InChIKey: WHNBDXQTMPYBAT-UHFFFAOYSA-N

Smiles:O1CC1CCCC

¹HNMR

¹³CNMR

IR1

Mass

MS-IW-5649          
1,2-epoxyhexane
C6H12O              (Mass of molecular ion:    100)

   Source Temperature: 220 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      15.0       2.4
      18.0       1.9
      26.0       1.8
      27.0      22.3
      28.0       6.3
      29.0      30.9
      30.0       2.3
      31.0      13.7
      38.0       1.6
      39.0      20.8
      40.0       5.1
      41.0      66.8
      42.0      67.6
      43.0      22.1
      44.0      15.0
      45.0       7.0
      50.0       1.2
      51.0       1.7
      53.0       5.8
      54.0       4.6
      55.0      50.4
      56.0      15.1
      57.0      20.7
      58.0      44.8
      59.0       3.1
      65.0       1.7
      67.0      19.3
      68.0       3.7
      69.0       4.3
      70.0       6.1
      71.0     100.0
      72.0       9.0
      79.0       1.5
      81.0       2.2
      82.0       7.9
      83.0       1.6
      85.0       7.8

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₆ H₁₂ O	0.05 ml : 0.5 ml CDCl₃
1,2-epoxyhexane

    Assign.     Shift(ppm)

      A             2.896
      B             2.732
      C             2.452
      D             1.527
      E             1.45
      F             1.39
      G             0.921

     Hz     ppm     Int.

   1166.50   2.919     83
   1163.70   2.912    104
   1162.48   2.909    125
   1161.01   2.906    164
   1159.79   2.903    141
   1158.33   2.899    180
   1157.10   2.896    182
   1155.40   2.892    138
   1154.30   2.889    172
   1152.71   2.885    120
   1151.49   2.882    119
   1148.80   2.875    104
   1096.56   2.744    329
   1092.53   2.734    334
   1091.43   2.731    383
   1087.40   2.721    312
    984.01   2.463    336
    981.32   2.456    331
    978.88   2.450    310
    976.20   2.443    294
    616.82   1.544    324
    611.45   1.530    264
    609.25   1.525    328
    603.64   1.511    270
    587.04   1.469    173
    580.57   1.453    212
    579.59   1.451    187
    573.24   1.435    217
    565.92   1.417    226
    562.99   1.409    159
    561.77   1.406    189
    560.55   1.403    214
    558.23   1.397    204
    553.59   1.386    317
    546.39   1.368    236
    545.29   1.365    179
    375.00   0.939    642
    367.92   0.921   1000
    363.28   0.909    153
    360.60   0.903    507

in CDCl3