70626373 -OEChem-03292411252D 45 45 0 1 0 0 0 0 0999 V2000 4.5981 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 2.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 0.3840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.2500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7320 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2500 0.0000 C 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 3.7320 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 2.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1494 1.0380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8397 0.6394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -3.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -2.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 2.4260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 2.6530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6951 1.8060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -4.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -4.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -2.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -3.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 4.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 3.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8520 2.1160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 3.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 4.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 4.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 20 1 0 0 0 0 2 16 1 0 0 0 0 2 42 1 0 0 0 0 3 13 2 0 0 0 0 4 16 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 5 16 1 0 0 0 0 6 11 2 0 0 0 0 6 12 1 0 0 0 0 7 17 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 18 1 0 0 0 0 9 19 1 0 0 0 0 9 26 1 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 11 14 1 0 0 0 0 11 27 1 0 0 0 0 12 15 2 0 0 0 0 12 28 1 0 0 0 0 14 29 1 0 0 0 0 15 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 M END > 70626373 > 1 > 356 > 4 > 1 > 8 > AAADceB4OAAAAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAGgAACAAADwCgmAIyCIAABgCIAiDSCAACAAAgAAAIiAEAAIgIIDaIFRCCYAAl4AEIiAeIyOCPwAAAAAAAAACAAAAAAAAAAAAAAAAAAA== > 2-ethoxycarbonyl-2-(4-isobutylphenyl)butanoic acid > 2-ethoxycarbonyl-2-[4-(2-methylpropyl)phenyl]butanoic acid > 2-ethoxycarbonyl-2-[4-(2-methylpropyl)phenyl]butanoic acid > 2-ethoxycarbonyl-2-[4-(2-methylpropyl)phenyl]butanoic acid > 2-ethoxycarbonyl-2-[4-(2-methylpropyl)phenyl]butanoic acid > 2-carbethoxy-2-(4-isobutylphenyl)butyric acid > InChI=1S/C17H24O4/c1-5-17(15(18)19,16(20)21-6-2)14-9-7-13(8-10-14)11-12(3)4/h7-10,12H,5-6,11H2,1-4H3,(H,18,19) > OTHFSCGTFRWYDC-UHFFFAOYSA-N > 4.2 > 292.16745924 > C17H24O4 > 292.4 > CCC(C1=CC=C(C=C1)CC(C)C)(C(=O)O)C(=O)OCC > CCC(C1=CC=C(C=C1)CC(C)C)(C(=O)O)C(=O)OCC > 63.6 > 292.16745924 > 0 > 21 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 14 8 10 15 8 11 14 8 12 15 8 5 7 3 6 11 8 6 12 8 $$$$