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1072-43-1

硫化丙烯(1072-43-1)Raman光谱

产品名称:硫化丙烯

CAS:1072-43-1

分子式:C3H6S

分子量: 74.14

InChI:InChI=1S/C3H6S/c1-3-2-4-3/h3H,2H2,1H3

InChIKey: MBNVSWHUJDDZRH-UHFFFAOYSA-N

Smiles:S1CC1C

90 MHz in CDCl3

400 MHz in CDCl3

parameter in CCl4

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    1H NMR 89.56 MHz
    C3 H6 S 0.04 ml : 0.5 ml CDCl3
    1,2-epithiopropane
    ChemicalStructure
        Assign.     Shift(ppm)
    A 2.90 B 2.497 C 2.107 D 1.512

         Hz     ppm     Int.
    

        269.75   3.012     80
        264.00   2.948    154
        258.31   2.885    156
        257.75   2.878    169
        254.63   2.844     31
        253.88   2.835     38
        252.13   2.816    130
        246.56   2.754     48
        226.81   2.533    224
        225.94   2.523    226
        222.88   2.489     35
        220.63   2.464    161
        219.69   2.453    174
        191.81   2.142    194
        191.06   2.134    184
        186.13   2.079    174
        185.50   2.072    160
        138.13   1.543   1000
        135.25   1.511     87
        133.94   1.496    145
        132.38   1.479    904
    

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    1H NMR 399.65 MHz
    C3 H6 S 0.05 ml : 0.5 ml CDCl3
    1,2-epithiopropane
    ChemicalStructure
        Assign.     Shift(ppm)
    A 2.912 B 2.500 C 2.114 D 1.511 J(A,D)=5.6HZ. J(A,C)=5.6HZ. J(B,C)=0.8HZ. J(A,B)=6.4HZ.

         Hz     ppm     Int.
    

       1178.71   2.950     43
       1172.97   2.935    154
       1167.24   2.921    265
       1161.38   2.906    261
       1155.27   2.891    164
       1149.54   2.877     50
       1002.44   2.509    283
       1001.59   2.507    307
        996.22   2.493    265
        995.24   2.491    292
        848.14   2.123    264
        847.17   2.120    276
        842.53   2.109    250
        842.16   2.108    255
        841.55   2.106    270
        619.51   1.551     49
        613.77   1.536     64
        606.81   1.519   1000
        603.52   1.511     91
        601.07   1.504   1000
        594.24   1.487     34
    

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    1H NMR 300 MHz
    C3 H6 S in CCl4
    1,2-epithiopropane
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 2.79 D(B) 2.40 D(C) 2.01 J(A,B) 6.22 J(A,C) 5.40 J(B,C) -0.86 D(D) 1.50 OHTSUKA,M. ET AL. TETRAHEDRON LETT. 33, 2877 (1970)

         Hz     ppm     Int.
    

        842.92   2.810     78
        837.50   2.792     97
        836.74   2.789    101
        831.32   2.771     91
        723.44   2.411    102
        722.63   2.409    103
        717.22   2.391     92
        716.40   2.388     93
        606.09   2.020    101
        605.27   2.018    100
        600.68   2.002     96
        599.86   2.000     95
        450.00   1.500   1000
    

in CDCl3

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liquid film

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