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5267-64-1

D-苯丙氨醇(5267-64-1)核磁图(1HNMR)

产品名称:D-苯丙氨醇

CAS:5267-64-1

分子式:C9H13NO

分子量: 151.21

InChI:InChI=1/C9H13NO/c10-9(7-11)6-8-4-2-1-3-5-8/h1-5,9,11H,6-7,10H2/t9-/s3

InChIKey: STVVMTBJNDTZBF-DJEYLCQNNA-N

Smiles:C(C1C=CC=CC=1)[C@@H](N)CO |&1:7,r|

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    Mass

    MS-IW-9101          
    (R)-(+)-2-amino-3-phenyl-1-propanol
    C9H13NO             (Mass of molecular ion:    151)
    

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

          15.0       1.4
          18.0       4.0
          27.0       1.1
          28.0       4.9
          29.0       1.0
          30.0       4.5
          31.0       1.3
          39.0       3.6
          41.0       1.7
          42.0      15.9
          43.0       2.5
          44.0       2.9
          50.0       1.3
          51.0       3.6
          52.0       1.0
          56.0       1.2
          59.0       1.3
          59.5       1.4
          60.0     100.0
          61.0       2.8
          63.0       2.0
          65.0       6.0
          77.0       6.7
          78.0       2.5
          79.0       1.1
          89.0       1.5
          91.0      19.0
          92.0       4.0
          93.0       2.5
         103.0       9.1
         104.0       4.5
         105.0       1.3
         115.0       2.3
         116.0       2.1
         117.0       2.3
         118.0       2.7
         119.0       1.4
         120.0      31.8
         121.0       3.0
         130.0       1.0
         132.0       5.0
         133.0       3.2
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C9 H13 N O 0.042 g : 0.5 ml CDCl3
    (R)-(+)-2-amino-3-phenyl-1-propanol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.292 B 7.22 C 7.186 D *1 3.608 E *1 3.384 F 3.098 G *2 2.776 J *2 2.504

         Hz     ppm     Int.
    

       2923.95   7.317    225
       2922.85   7.314    359
       2921.26   7.310    154
       2917.60   7.301    261
       2915.89   7.297   1000
       2912.11   7.287     66
       2909.67   7.281    340
       2908.33   7.278    812
       2891.85   7.236    184
       2890.50   7.233    376
       2889.16   7.230    273
       2887.33   7.225     44
       2885.38   7.220    135
       2883.18   7.215    502
       2880.86   7.209    147
       2875.00   7.194    855
       2873.54   7.191    938
       2866.82   7.174    688
       1450.07   3.629    392
       1446.29   3.619    409
       1439.33   3.602    496
       1435.55   3.593    499
       1361.08   3.406    441
       1353.88   3.388    499
       1350.34   3.379    364
       1343.14   3.361    409
       1250.49   3.129    107
       1246.58   3.120    129
       1245.36   3.117    143
       1243.29   3.111    136
       1241.70   3.107    234
       1239.38   3.102    136
       1238.04   3.098    252
       1236.69   3.095    158
       1234.50   3.089    220
       1232.79   3.085    148
       1230.71   3.080    129
       1229.49   3.077    129
       1225.59   3.067    103
       1119.51   2.802    272
       1114.38   2.789    255
       1106.08   2.768    343
       1100.95   2.755    316
       1011.11   2.530    381
       1002.32   2.508    362
        997.56   2.497    311
        988.89   2.475    289
    

in CDCl3

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KBr disc

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nujol mull

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