Mrv0541 02241220542D 14 12 0 0 0 0 999 V2000 0.0000 0.0000 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 2.3055 -0.5875 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.7180 0.1269 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0036 0.5394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1305 0.8414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4325 -0.2856 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1470 0.1269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8615 -0.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5759 0.1269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2904 -0.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0049 0.1269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7193 -0.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4338 0.1269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1483 -0.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 M CHG 2 1 1 2 -1 M END > NP0338410 > NP-MRD > [Na+].CCCCCCCCOS([O-])(=O)=O > InChI=1S/C8H18O4S.Na/c1-2-3-4-5-6-7-8-12-13(9,10)11;/h2-8H2,1H3,(H,9,10,11);/q;+1/p-1 > WFRKJMRGXGWHBM-UHFFFAOYSA-M > C8H17NaO4S > 232.273 > 232.074524397 > 3 > 22.661483148228317 > 1 > 0 > 0 > 1 > sodium octyl sulfate > 1.94 > 2.638582373999999 > -2.70 > 0 > 0 > -1 > -1.450855135938677 > 66.42999999999999 > 49.40899999999999 > 8 > 1 > 4.66e-01 g/l > sodium n-octyl sulfate > 0 > NP0338410 > Sodium octyl sulfate $$$$