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286-20-4

氧化环己烯(286-20-4)核磁图(13CNMR)

产品名称:氧化环己烯

CAS:286-20-4

分子式:C6H10O

分子量: 98.14

InChI:InChI=1S/C6H10O/c1-2-4-6-5(3-1)7-6/h5-6H,1-4H2

InChIKey: ZWAJLVLEBYIOTI-UHFFFAOYSA-N

Smiles:C12C(O1)CCCC2

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    Mass

    MS-NW-0833          
    1,2-epoxycyclohexane
    C6H10O              (Mass of molecular ion:     98)
    

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

          15.0       3.1
          18.0       1.7
          26.0       4.6
          27.0      33.2
          28.0       8.1
          29.0      17.9
          31.0       3.0
          37.0       1.9
          38.0       4.8
          39.0      49.1
          40.0      10.3
          41.0      87.6
          42.0      79.2
          43.0      19.4
          44.0      19.1
          50.0       3.5
          51.0       4.8
          52.0       2.2
          53.0      10.4
          54.0      58.4
          55.0      32.6
          56.0      16.7
          57.0      41.2
          58.0       1.9
          65.0       2.3
          67.0      10.1
          68.0      12.3
          69.0      26.0
          70.0      27.0
          71.0       3.7
          77.0       4.4
          78.0       1.8
          79.0      12.3
          80.0       8.5
          81.0       1.8
          82.0       1.1
          83.0     100.0
          84.0       5.7
          97.0      15.4
          98.0      16.1
          99.0       1.2
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C6 H10 O 0.05 ml : 0.5 ml CDCl3
    1,2-epoxycyclohexane
    ChemicalStructure
        Assign.     Shift(ppm)
    A 3.109 B *1 1.937 C *1 1.817 D *2 1.419 E *2 1.234 ASSIGNED BY C-H COSY.

         Hz     ppm     Int.
    

       1245.12   3.116    594
       1244.14   3.114    995
       1243.04   3.111    997
       1241.82   3.108   1000
       1240.72   3.105    961
       1239.75   3.103    561
       1231.93   3.083     32
       1230.83   3.080     33
        794.43   1.988     33
        789.92   1.977    170
        783.81   1.962    238
        782.96   1.960    255
        776.73   1.944    254
        775.88   1.942    283
        774.90   1.939    317
        772.09   1.932    140
        767.82   1.922    445
        767.21   1.920    427
        761.72   1.906    321
        743.16   1.860     37
        740.11   1.852    172
        739.26   1.850    184
        737.67   1.846    197
        736.94   1.844    224
        733.89   1.837    351
        732.79   1.834    354
        731.45   1.831    384
        730.59   1.829    330
        729.61   1.826    227
        727.29   1.820    262
        726.44   1.818    244
        724.37   1.813    281
        721.80   1.807    167
        718.75   1.799    205
        717.77   1.796    223
        716.31   1.793    220
        715.45   1.791    207
        714.48   1.788    145
        713.38   1.786    117
        712.40   1.783    149
        711.55   1.781    146
        710.21   1.778    128
        709.11   1.775    129
        706.30   1.768     37
        587.65   1.471     99
        585.69   1.466     79
        580.93   1.454    130
        578.86   1.449    197
        576.90   1.444    183
        576.05   1.442    197
        574.58   1.438    173
        572.51   1.433    350
        570.68   1.428    247
        569.46   1.425    195
        568.12   1.422    271
        566.04   1.417    416
        564.09   1.412    188
        561.77   1.406    262
        559.94   1.402    323
        558.72   1.399    344
        557.25   1.395    133
        556.27   1.392    110
        555.18   1.390    110
        554.32   1.388    139
        553.34   1.385    170
        552.49   1.383    166
        551.03   1.379    137
        548.10   1.372     45
        514.04   1.287     30
        510.99   1.279    128
        509.40   1.275    142
        508.67   1.273    171
        507.45   1.270    117
        506.84   1.269    111
        504.64   1.263    107
        502.93   1.259    335
        501.34   1.255    280
        500.24   1.252    244
        499.27   1.250    193
        498.17   1.247    191
        495.73   1.241    424
        493.29   1.235    266
        490.23   1.227    267
        489.26   1.225    303
        486.82   1.219    175
        486.08   1.217    186
        485.23   1.215    192
        484.25   1.212    171
        482.42   1.208    212
        480.96   1.204    157
        479.49   1.200    106
        478.76   1.198    103
        475.83   1.191     84
        474.73   1.188     63
        473.51   1.185    101
    

in CDCl3

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liquid film

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4880 A,200 M,liquid

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