HMDB0029820 RDKit 3D 2,6-Diisopropyl-3-methylphenol 34 34 0 0 0 0 0 0 0 0999 V2000 -2.2046 2.4000 -0.3806 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9655 1.5792 -0.2289 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2228 2.1465 0.1167 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3696 1.3769 0.2753 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3907 0.0311 0.0886 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5976 -0.7901 0.0087 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 -1.1415 1.3125 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6502 0.2234 -0.6372 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1264 -0.5833 -0.2839 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3076 -1.9202 -0.4402 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 0.1647 -0.4242 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3473 -0.3265 -0.7057 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1618 -0.2430 0.6348 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3760 -1.8563 -0.9302 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7287 2.5146 0.6121 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9059 3.4498 -0.6338 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8609 2.0773 -1.1994 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2324 3.1981 0.2626 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3091 1.8860 0.5589 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5291 -1.5966 -0.7183 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5846 -2.2326 1.1796 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6145 -1.0463 2.1822 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2412 -0.6285 1.4565 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3718 -0.4033 -1.1521 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1109 0.8621 -1.3297 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1609 0.7476 0.2177 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1445 -2.6826 -0.8193 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8199 0.1689 -1.5241 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9771 0.4710 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4753 0.0613 1.4279 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6042 -1.1987 0.8882 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4992 -2.1684 -0.8727 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0408 -2.1958 -1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0107 -2.3447 0.0328 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 6 8 1 0 5 9 1 0 9 10 1 0 9 11 2 0 11 12 1 0 12 13 1 0 12 14 1 0 11 2 1 0 1 15 1 0 1 16 1 0 1 17 1 0 3 18 1 0 4 19 1 0 6 20 1 0 7 21 1 0 7 22 1 0 7 23 1 0 8 24 1 0 8 25 1 0 8 26 1 0 10 27 1 0 12 28 1 0 13 29 1 0 13 30 1 0 13 31 1 0 14 32 1 0 14 33 1 0 14 34 1 0 M END