4,4'-Dithiodimorpholine(103-34-4) ¹³C NMR

Product Name4,4'-Dithiodimorpholine

CAS 103-34-4

Molecular FormulaC8H16N2O2S2

Molecular Weight236.35

InChIInChI=1S/C8H16N2O2S2/c1-5-11-6-2-9(1)13-14-10-3-7-12-8-4-10/h1-8H2

InChIKey HLBZWYXLQJQBKU-UHFFFAOYSA-N

SmilesS(N1CCOCC1)SN1CCOCC1

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Mass

MS-NW-1642          
4,4'-dithiodimorpholine
C8H16N2O2S2         (Mass of molecular ion:    236)

   Source Temperature: 180 °C
   Sample Temperature: 120 °C
   Direct, 75 eV

      15.0       7.7
      18.0       2.0
      26.0       3.3
      27.0      13.6
      28.0      41.7
      29.0      21.8
      30.0      15.6
      31.0       4.8
      32.0       1.7
      40.0       1.1
      41.0       4.8
      42.0      17.0
      43.0       2.9
      44.0       6.2
      45.0       1.9
      46.0       2.2
      47.0       2.1
      54.0       7.8
      55.0      30.1
      56.0      87.0
      57.0      20.8
      58.0       2.6
      59.0       4.5
      60.0      27.9
      61.0       6.2
      62.0       2.4
      64.0      12.8
      66.0       1.3
      72.0       1.8
      74.0       3.5
      84.0      14.2
      85.0      18.6
      86.0     100.0
      87.0      21.3
      88.0       9.6
      89.0       1.8
      90.0       2.9
     116.0      45.3
     117.0       3.3
     118.0      55.6
     119.0       3.5
     120.0       2.7
     149.0      42.5
     150.0      54.8
     151.0      15.6
     152.0       5.6
     153.0       1.2
     236.0      26.5
     237.0       3.0
     238.0       2.6

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₈ H₁₆ N₂ O₂ S₂	0.044 g : 0.5 ml CDCl₃
4,4'-dithiodimorpholine

    Assign.     Shift(ppm)

      A             3.735
      B             2.830

     Hz     ppm     Int.

    339.50   3.791    806
    336.31   3.756    493
    334.94   3.740    864
    332.81   3.717    528
    330.06   3.686   1000
    326.00   3.641     44
    325.31   3.633     40
    260.56   2.910     36
    257.81   2.879    801
    255.00   2.848    403
    252.94   2.825    717
    251.63   2.810    413
    250.00   2.792    135
    248.38   2.774    649

in CDCl3