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|

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

¹H NMR	399.65 MHz
C₉ H₁₃ N O	0.042 g : 0.5 ml CDCl₃
(R)-(+)-2-amino-3-phenyl-1-propanol

    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