2-tert-Butyl-1,3-oxathiolan-5-one(60822-66-4) ¹H NMR

Product Name2-tert-Butyl-1,3-oxathiolan-5-one

CAS 60822-66-4

Molecular FormulaC7H12O2S

Molecular Weight160.23

InChIInChI=1S/C7H12O2S/c1-7(2,3)6-9-5(8)4-10-6/h6H,4H2,1-3H3

InChIKey VGOAJBAPHMFWJP-UHFFFAOYSA-N

SmilesO1C(=O)CSC1C(C)(C)C

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¹HNMR

    Parameter     ppm  Hz

      D(A)         5.20
      D(B)         3.50
      D(C)         3.61
       J(A,B)          0.7
       J(A,C)          0.4
       J(B,C)        -16.5
     
      D(D)         1.01
     
     PIHLAJA,K. ET AL. ACTA CHEM.SCAND. A 30, 457 (1976)

Spectral Code: 1H NMR : parameter in CCl4

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2-tert-Butyl-1,3-oxathiolan-5-one(60822-66-4) 1H NMR

2-tert-Butyl-1,3-oxathiolan-5-one(60822-66-4) ¹H NMR