70674906 -OEChem-03282421092D 53 51 0 1 0 0 0 0 0999 V2000 10.6603 -1.6651 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -1.6651 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 7.1962 -2.6651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.1651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -1.1651 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 11.1603 -2.5311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1603 -0.7990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.1651 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5622 -1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5622 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5622 -3.0311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5622 2.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.0311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0872 -0.9005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0872 -1.6976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5371 -0.8315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5371 -0.0345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3267 -1.1901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 -1.1901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0872 0.8315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0872 0.0345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0252 -3.3411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8722 -3.5680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0991 -2.7211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -1.6901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -1.6901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5371 0.9005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5371 1.6976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 -3.1400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -3.1400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -1.6901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -1.6901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0872 2.5636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0872 1.7665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 -3.1400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 -3.1400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 -1.6901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 -1.6901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 2.7211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3722 3.5680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 3.3411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.1281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.9751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -3.2020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 1 6 2 0 0 0 0 1 7 2 0 0 0 0 3 8 1 0 0 0 0 3 14 1 0 0 0 0 4 11 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 15 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 16 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 18 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 19 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 21 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 22 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 M CHG 2 2 1 5 -1 M END > 70674906 > 1 > 342 > 5 > 0 > 14 > AAADceBwOCBAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAAAAAADESggAICAAAABAAAAAAAADAAAAAAAAAAAAAAAAABAAIAAAACAAAEAAACAAGAwOAMAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > sodium;(2-hexoxy-2-methyl-octyl) sulfate > sodium;(2-hexoxy-2-methyloctyl) sulfate > sodium;(2-hexoxy-2-methyloctyl) sulfate > sodium;(2-hexoxy-2-methyloctyl) sulfate > sodium;(2-hexoxy-2-methyl-octyl) sulfate > sodium;(2-hexoxy-2-methyl-octyl) sulfate > InChI=1S/C15H32O5S.Na/c1-4-6-8-10-12-15(3,14-20-21(16,17)18)19-13-11-9-7-5-2;/h4-14H2,1-3H3,(H,16,17,18);/q;+1/p-1 > RVWGNUYJOAFMKW-UHFFFAOYSA-M > 346.17898954 > C15H31NaO5S > 346.5 > CCCCCCC(C)(COS(=O)(=O)[O-])OCCCCCC.[Na+] > CCCCCCC(C)(COS(=O)(=O)[O-])OCCCCCC.[Na+] > 84 > 346.17898954 > 0 > 22 > 0 > 1 > 0 > 0 > 0 > 2 > -1 > 2 5 7 > 1 5 255 > 8 13 3 $$$$