Mrv0541 02241211472D 14 14 0 0 0 0 999 V2000 -1.4273 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4273 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7136 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0014 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0014 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7136 1.0299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7136 1.8549 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7135 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7135 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7136 -1.4437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4286 -1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0013 -1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4286 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7135 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 M END > NP0248675 > NP-MRD > CC(C)C1=C(C)C(C(C)C)=C(O)C=C1 > InChI=1S/C13H20O/c1-8(2)11-6-7-12(14)13(9(3)4)10(11)5/h6-9,14H,1-5H3 > NAOSNNNYJHAZGY-UHFFFAOYSA-N > C13H20O > 192.2973 > 192.151415262 > 1 > 23.573203888569317 > 1 > 1 > 0 > 1 > 3-methyl-2,4-bis(propan-2-yl)phenol > 4.18 > 4.673120185 > -3.17 > 0 > 1 > 0 > 10.864697585578408 > -5.196278289284231 > 20.23 > 61.46169999999999 > 2 > 1 > 1.32e-01 g/l > 2,4-diisopropyl-3-methylphenol > 1 > NP0248675 > diisopropyl cresol $$$$