50363-48-9

1,3-Dithiolane,4-methyl-2-(1-methylethyl)-,cis-(9CI)(50363-48-9) ¹H NMR

Product Name1,3-Dithiolane,4-methyl-2-(1-methylethyl)-,cis-(9CI)

CAS 50363-48-9

Molecular FormulaC7H14S2

Molecular Weight162.32

InChIInChI=1/C7H14S2/c1-5(2)7-8-4-6(3)9-7/h5-7H,4H2,1-3H3/t6-,7+/s3

InChIKey FFEFMICFXSDLAM-ZCIVMJCZNA-N

SmilesS1C[C@@H](C)S[C@H]1C(C)C |&1:2,5,r|

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¹HNMR

1,3-Dithiolane,4-methyl-2-(1-methylethyl)-,cis-(9CI)(50363-48-9) <sup>1</sup>H NMR

    Parameter     ppm  Hz

      D(A)         3.683
      D(B)         3.097
      D(C)         2.782
      D(D)         1.403
       J(A,B)          5.05
       J(A,C)          7.72
       J(A,D)          6.42
       J(B,C)        -11.16
       J(B,D)          0.0
       J(C,D)          0.0
     
      D(E)         4.217
      D(F)         1.917
      D(G)         1.042
       J(E,F)          6.65
       J(E,G)          0.0
       J(F,G)          6.34
     
     KESKINEN,R. ET AL. J.CHEM.SOC.,PERKIN TRANS. 2 1973, 1376

Spectral Code: 1H NMR : parameter in CCl4

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1,3-Dithiolane,4-methyl-2-(1-methylethyl)-,cis-(9CI)(50363-48-9) 1H NMR

1,3-Dithiolane,4-methyl-2-(1-methylethyl)-,cis-(9CI)(50363-48-9) ¹H NMR