Mrv1652310081712262D 11 10 0 0 0 0 999 V2000 -0.1914 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2375 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6664 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3809 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5243 1.5395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2224 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3974 1.8414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0954 0.7145 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8099 1.1270 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 1 0 0 0 0 4 3 1 0 0 0 0 5 4 1 0 0 0 0 6 5 1 0 0 0 0 10 6 1 0 0 0 0 11 7 1 0 0 0 0 11 8 2 0 0 0 0 11 9 2 0 0 0 0 11 10 1 0 0 0 0 M END > NP0204066 > NP-MRD > CCCCCCOS(O)(=O)=O > InChI=1S/C6H14O4S/c1-2-3-4-5-6-10-11(7,8)9/h2-6H2,1H3,(H,7,8,9) > IDUWTCGPAPTSFB-UHFFFAOYSA-N > C6H14O4S > 182.23 > 182.061280105 > 3 > 25 > 18.782101240931773 > 1 > 1 > 0 > 1 > (hexyloxy)sulfonic acid > -0.07 > 1.749445044 > -1.86 > 0 > 0 > -1 > -1.4189082803782815 > 63.599999999999994 > 41.3287 > 6 > 1 > 2.52e+00 g/l > hexyloxysulfonic acid > 0 > NP0204066 > hexyloxysulfonic acid $$$$