1-EICOSANYL SULFATE SODIUM SALT(13177-49-6) IR2

Product Name1-EICOSANYL SULFATE SODIUM SALT

Molecular FormulaC20H41NaO4S

Molecular Weight400.59

InChIInChI=1S/C20H42O4S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-25(21,22)23;/h2-20H2,1H3,(H,21,22,23);/q;+1/p-1

InChIKey QNVVZAPPULYURG-UHFFFAOYSA-M

SmilesC(COS([O-])(=O)=O)CCCCCCCCCCCCCCCCCC.[Na+]

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¹HNMR

IR1

IR2

90 MHz in DMSO-d6

¹H NMR	89.56 MHz
C₂₀ H₄₁ Na O₄ S	0.037 g : 0.5 ml DMSO-d₆
sodium icosyl sulfate

    Assign.     Shift(ppm)

      A             3.67
      B             1.45
      C             1.24
      D             0.86

     Hz     ppm     Int.

    329.38   3.678     35
    125.38   1.400     28
    125.06   1.397     29
    124.63   1.392     28
    124.31   1.389     28
    123.56   1.380     27
    123.00   1.374     28
    122.31   1.366     29
    120.69   1.348     34
    110.88   1.239   1000
    103.25   1.153     29
    102.44   1.144     26
    102.06   1.140     25
     76.44   0.854     39

KBr disc

nujol mull

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