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Back ChemicalBook Home>CAS DataBase List>3182-95-4More Spectrum> L-Phenylglycinol(3182-95-4) 1H NMR

L-Phenylglycinol(3182-95-4) 1H NMR

Product NameL-Phenylglycinol

CAS3182-95-4

Molecular FormulaC9H13NO

Molecular Weight151.21

InChIInChI=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

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


  • Mass

    MS-NW-6201          
    L-2-amino-3-phenyl-1-propanol
    C9H13NO             (Mass of molecular ion:    151)
    

       Source Temperature: 260 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          15.0       1.6
          18.0       1.4
          28.0       3.3
          30.0       3.6
          31.0       1.3
          39.0       3.0
          41.0       1.4
          42.0      14.7
          43.0       1.9
          50.0       1.0
          51.0       2.5
          59.0       1.2
          59.5       1.2
          60.0     100.0
          61.0       2.7
          63.0       1.6
          65.0       4.4
          77.0       5.1
          78.0       1.2
          89.0       1.1
          91.0      12.7
          92.0       3.1
          93.0       1.9
         103.0       7.4
         104.0       1.5
         117.0       1.3
         118.0       1.9
         119.0       1.3
         120.0      33.0
         121.0       3.2
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C9 H13 N O 0.039 g : 0.5 ml CDCl3
    L-2-amino-3-phenyl-1-propanol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.287 B 7.20 C 7.19 D *1 3.591 E *1 3.374 F 3.093 G *2 2.777 J *2 2.513 K 2.4 J(D,E)=-10.6HZ J(D,F)=4.0HZ J(E,F)=7.2HZ J(F,G)=5.3HZ J(F,J)=8.5HZ J(G,J)=-13.4HZ

         Hz     ppm     Int.
    

       2922.12   7.312    236
       2921.14   7.310    343
       2919.56   7.306    182
       2915.89   7.297    318
       2914.06   7.292    864
       2910.64   7.283    131
       2908.08   7.277    351
       2906.74   7.274    775
       2888.92   7.229    173
       2887.57   7.226    354
       2886.23   7.222    323
       2878.91   7.204   1000
       2877.44   7.200    975
       2875.12   7.195    229
       2874.39   7.193    225
       2870.73   7.184    735
       1443.24   3.612    381
       1439.21   3.602    401
       1432.62   3.585    487
       1428.59   3.575    473
       1357.18   3.396    426
       1349.98   3.378    488
       1346.44   3.370    353
       1339.36   3.352    392
       1248.41   3.124    105
       1244.38   3.114    125
       1243.16   3.111    147
       1241.21   3.106    139
       1239.75   3.103    188
       1239.26   3.101    188
       1237.30   3.096    143
       1235.96   3.093    259
       1234.62   3.090    171
       1232.67   3.085    178
       1230.71   3.080    155
       1228.76   3.075    133
       1227.54   3.072    134
       1223.51   3.062    103
       1120.12   2.803    260
       1114.87   2.790    246
       1106.69   2.770    336
       1101.44   2.757    305
       1015.01   2.540    374
       1006.47   2.519    367
       1001.59   2.507    322
        993.04   2.485    306
    

in CDCl3



KBr disc



nujol mull





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