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Back ChemicalBook Home>CAS DataBase List>881-95-8More Spectrum> DL-M-O-METHYLEPINEPHRINE HYDROCHLORIDE(881-95-8) 13C NMR

881-95-8

DL-M-O-METHYLEPINEPHRINE HYDROCHLORIDE(881-95-8) 13C NMR

Molecular FormulaC10H16ClNO3

Molecular Weight233.69

InChIInChI=1S/C10H15NO3.ClH/c1-11-6-9(13)7-3-4-8(12)10(5-7)14-2;/h3-5,9,11-13H,6H2,1-2H3;1H

InChIKey HRIQFVCFOPJYEQ-UHFFFAOYSA-N

SmilesC1(=CC=C(O)C(OC)=C1)C(O)CNC.Cl

  • DL-M-O-METHYLEPINEPHRINE HYDROCHLORIDE(881-95-8) <sup>13</sup>C NMR
    Mass

    MS-NW-6966          
    (+-)-4-hydroxy-3-methoxy-alpha-(methylaminomethyl)benzyl alcohol hydrochloride
    C10H15NO3 HCl       (Mass of molecular ion:    197)
    

       Source Temperature: 210 °C
       Sample Temperature: 130 °C
       Direct, 75 eV
    

          15.0       1.1
          18.0       2.7
          27.0       1.2
          28.0       1.9
          30.0       1.9
          35.0       1.4
          36.0       7.9
          38.0       2.8
          39.0       2.6
          42.0       4.7
          43.0       1.7
          44.0     100.0
          45.0       7.2
          46.0      13.0
          51.0       1.8
          52.0       1.4
          53.0       1.8
          55.0       1.3
          63.0       1.0
          65.0       6.8
          66.0       1.1
          77.0       1.7
          81.0       2.4
          82.0       2.1
          93.0      12.2
          94.0       1.9
         109.0       1.2
         110.0       2.0
         122.0       1.1
         123.0       2.2
         125.0       3.5
         137.0       1.7
         138.0       4.3
         151.0       2.9
         152.0       4.4
         153.0       9.2
         154.0       4.9
         179.0       2.6
         197.0       3.9
    

400 MHz in DMSO-d6

  • DL-M-O-METHYLEPINEPHRINE HYDROCHLORIDE(881-95-8) <sup>13</sup>C NMR

    1H NMR 399.65 MHz
    C10 H15 N O3 0.038 g : 0.5 ml DMSO-d6
    (+-)-4-hydroxy-3-methoxy-alpha-(methylaminomethyl)benzyl alcohol hydrochloride
    ChemicalStructure
        Assign.     Shift(ppm)
    A 9.08 B 9. C 6.957 D 6.809 E 6.773 F 6.04 G 4.870 J 3.770 K *1 3.031 L *1 2.977 M 2.559

         Hz     ppm     Int.
    

       3632.81   9.090     89
       2781.37   6.960    161
       2779.54   6.955    165
       2727.36   6.825    109
       2719.27   6.805    269
       2710.27   6.782    128
       2708.44   6.778    121
       2702.03   6.761     52
       2700.35   6.757     52
       2414.86   6.043     90
       2410.74   6.033     90
       1950.68   4.881     47
       1946.72   4.872     37
       1944.89   4.867     40
       1940.92   4.857     49
       1506.65   3.770   1000
       1218.57   3.050     31
       1209.41   3.027     70
       1206.36   3.019     66
       1198.58   3.000     69
       1188.81   2.975     64
       1186.37   2.969     39
       1022.95   2.560    703
    

in DMSO-d6

  • DL-M-O-METHYLEPINEPHRINE HYDROCHLORIDE(881-95-8) <sup>13</sup>C NMR

KBr disc

  • DL-M-O-METHYLEPINEPHRINE HYDROCHLORIDE(881-95-8) <sup>13</sup>C NMR

nujol mull

  • DL-M-O-METHYLEPINEPHRINE HYDROCHLORIDE(881-95-8) <sup>13</sup>C NMR

DL-M-O-METHYLEPINEPHRINE HYDROCHLORIDE(881-95-8) 13C NMR Atlas of Related Products

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