23673833 -OEChem-03282415492D 16 14 0 0 0 0 0 0 0999 V2000 3.7320 -0.2500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2500 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 5.4641 0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.7500 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2320 0.6160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -1.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 -0.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 1.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5611 -0.9260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4081 -1.1530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6350 -0.3060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 1.4260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7881 1.6530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5611 0.8060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 7 1 0 0 0 0 3 7 1 0 0 0 0 3 16 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 13 1 0 0 0 0 9 14 1 0 0 0 0 9 15 1 0 0 0 0 M CHG 2 2 1 4 -1 M END > 23673833 > 1 > 165 > 4 > 1 > 1 > AAADcYBAOCBAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgQACAAACASAwAACAAAAAgIAAAAAAHBAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > sodium;2-hydroxypropane-2-sulfonate > sodium;2-hydroxy-2-propanesulfonate > sodium;2-hydroxypropane-2-sulfonate > sodium;2-hydroxypropane-2-sulfonate > sodium;2-oxidanylpropane-2-sulfonate > sodium;2-hydroxypropane-2-sulfonate > InChI=1S/C3H8O4S.Na/c1-3(2,4)8(5,6)7;/h4H,1-2H3,(H,5,6,7);/q;+1/p-1 > YNJORDSKPXMABC-UHFFFAOYSA-M > 161.99627416 > C3H7NaO4S > 162.14 > CC(C)(O)S(=O)(=O)[O-].[Na+] > CC(C)(O)S(=O)(=O)[O-].[Na+] > 85.8 > 161.99627416 > 0 > 9 > 0 > 0 > 0 > 0 > 0 > 2 > -1 > 2 4 7 > 1 5 255 $$$$