97145-88-5

N-METHYL-3-CHLOROPROPYLAMINE HYDROCHLORIDE(97145-88-5) ¹³C NMR

Product NameN-METHYL-3-CHLOROPROPYLAMINE HYDROCHLORIDE

CAS 97145-88-5

Molecular FormulaC4H10ClN.ClH

Molecular Weight144.04

InChIInChI=1S/C4H10ClN.ClH/c1-6-4-2-3-5;/h6H,2-4H2,1H3;1H

InChIKey SHBWHBGVZIDIQY-UHFFFAOYSA-N

SmilesC(CCl)CNC.Cl

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N-METHYL-3-CHLOROPROPYLAMINE HYDROCHLORIDE(97145-88-5) <sup>13</sup>C NMR
Mass

MS-IW-4085          
3-chloro-n-methylpropylamine hydrochloride
C4H10ClN HCl        (Mass of molecular ion:    107)

   Source Temperature: 170 °C
   Sample Temperature: 120 °C
   Direct, 75 eV

      15.0       3.2
      18.0       9.5
      27.0       4.2
      28.0       9.6
      29.0       1.7
      30.0      11.4
      35.0       4.1
      36.0      61.4
      37.0       1.4
      38.0      19.9
      39.0       3.6
      41.0       6.8
      42.0       9.3
      43.0       5.1
      44.0     100.0
      45.0       7.6
      49.0       1.7
      56.0       3.4
      57.0       6.2
      70.0       2.9
     106.0       3.7
     107.0      24.7
     108.0       3.5
     109.0       8.0

400 MHz in CDCl3

N-METHYL-3-CHLOROPROPYLAMINE HYDROCHLORIDE(97145-88-5) <sup>13</sup>C NMR

¹H NMR	399.65 MHz
C₄ H₁₀ Cl N	0.030 g : 0.5 ml CDCl₃
3-chloro-N-methylpropylamine hydrochloride

    Assign.     Shift(ppm)

      A             9.57
      B             3.736
      C             3.162
      D             2.735
      E             2.385

     Hz     ppm     Int.

   1499.48   3.752    212
   1496.28   3.744     30
   1493.38   3.737    263
   1489.72   3.728     32
   1487.12   3.722    221
   1271.36   3.182    124
   1264.04   3.163    162
   1256.41   3.144    137
   1093.14   2.736   1000
    966.49   2.419     49
    960.24   2.403    102
    959.01   2.400     70
    957.03   2.395     39
    956.12   2.393     38
    954.13   2.388    102
    952.45   2.384     97
    951.69   2.382    109
    949.86   2.377     38
    948.94   2.375     37
    947.72   2.372     45
    945.74   2.367     88
    939.18   2.351     44

in CDCl3