60196429 -OEChem-03282404242D 49 50 0 0 0 0 0 0 0999 V2000 4.5981 -1.5950 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 -1.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -1.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -0.1158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 -0.6297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -0.6192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 1.4397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 0.9258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -0.1225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1244 -1.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3509 -1.2496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6639 -0.9312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3509 2.0596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7998 1.2379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 3.4419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 3.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 2.3681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 2.3681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 3.4419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.4419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.6319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -1.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -1.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3041 -0.6606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5343 0.1854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6882 0.4156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5044 -1.6168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1220 -2.2391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7443 -1.6215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 9 1 0 0 0 0 2 49 1 0 0 0 0 5 8 1 0 0 0 0 5 10 1 0 0 0 0 5 12 2 0 0 0 0 6 9 2 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 8 16 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 10 24 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 14 27 1 0 0 0 0 15 22 1 0 0 0 0 15 23 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 30 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 M END > 60196429 > 1 > 489 > 3 > 1 > 4 > AAADceB4MABAAAAAAAAAAAAAAAAAAAAAAAAwYAAAAAAAAADBUAAAGAQACAAADQCAWAAyAcAAAIKAAiBCAHBCAEAgAAAIiBAAAIgIICKAERCAIAAggAAIiAcAgMAO0AACgAAUAACgAAUAACgAAAAAAAAAAA== > 2,4,7-triisopropylnaphthalene-1-sulfonic acid > 2,4,7-tri(propan-2-yl)-1-naphthalenesulfonic acid > 2,4,7-tri(propan-2-yl)naphthalene-1-sulfonic acid > 2,4,7-tri(propan-2-yl)naphthalene-1-sulfonic acid > 2,4,7-tri(propan-2-yl)naphthalene-1-sulfonic acid > 2,4,7-triisopropylnaphthalene-1-sulfonic acid > InChI=1S/C19H26O3S/c1-11(2)14-7-8-15-16(12(3)4)10-17(13(5)6)19(18(15)9-14)23(20,21)22/h7-13H,1-6H3,(H,20,21,22) > YYULUYUZVZOOKX-UHFFFAOYSA-N > 5.3 > 334.16026586 > C19H26O3S > 334.5 > CC(C)C1=CC2=C(C=C1)C(=CC(=C2S(=O)(=O)O)C(C)C)C(C)C > CC(C)C1=CC2=C(C=C1)C(=CC(=C2S(=O)(=O)O)C(C)C)C(C)C > 62.8 > 334.16026586 > 0 > 23 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 13 14 8 13 17 8 16 17 8 5 12 8 5 8 8 6 12 8 6 9 8 7 14 8 7 8 8 7 9 8 8 16 8 $$$$