3-Pyrroline(109-96-6) ¹³C NMR

Product Name3-Pyrroline

CAS 109-96-6

Molecular FormulaC4H7N

Molecular Weight69.11

InChIInChI=1S/C4H7N/c1-2-4-5-3-1/h1-2,5H,3-4H2

InChIKey JVQIKJMSUIMUDI-UHFFFAOYSA-N

SmilesN1CC=CC1

Request For Quotation

Mass

MS-NW-6777          
3-pyrroline
C4H7N               (Mass of molecular ion:     69)

   Source Temperature: 200 °C
   Sample Temperature: 190 °C
   Reservoir, 75 eV

      15.0       2.3
      18.0       4.2
      26.0       1.8
      27.0       4.1
      28.0      29.4
      29.0       1.4
      30.0       3.8
      33.5       2.1
      34.0       1.3
      37.0       3.4
      38.0       6.1
      39.0      22.5
      40.0       8.6
      41.0      45.9
      42.0      14.1
      43.0      38.1
      44.0       1.5
      52.0       1.0
      54.0       1.4
      66.0       1.1
      67.0      16.0
      68.0     100.0
      69.0      45.8
      70.0      16.5
      71.0      11.7

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₄ H₇ N	0.05 ml : 0.5 ml CDCl₃
3-pyrroline

    Assign.     Shift(ppm)

      A             5.860
      B             2.84
      C             1.68

     Hz     ppm     Int.

   2342.04   5.861   1000
   2337.77   5.850    125
   1141.97   2.858    337
   1140.99   2.855    318
   1139.40   2.851    325
   1135.25   2.841    564
   1131.10   2.831    307
   1129.39   2.826    304
   1128.54   2.824    320
    677.12   1.695    223
    673.46   1.686    264
    670.41   1.678    518
    667.24   1.670    243

in CDCl3