HMDB0029824 RDKit 3D 2,4-Diisopropyl-3-methylphenol 34 34 0 0 0 0 0 0 0 0999 V2000 -0.0753 -1.7828 0.8844 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0602 -0.4333 0.3159 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2552 0.0802 -0.0986 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4917 -0.6024 0.1722 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3076 -1.2098 -0.9616 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4995 0.6049 0.5708 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2309 1.3515 -0.6014 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0517 2.0860 -0.6877 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1384 1.5579 -0.2718 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2833 2.3410 -0.3774 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1595 0.2779 0.2359 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4358 -0.3866 0.4897 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5515 0.5870 0.8807 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9113 -1.0252 -0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7971 -2.4885 0.3738 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2269 -1.7211 1.9931 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8886 -2.2940 0.7448 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 -1.2455 1.0618 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2296 -0.7314 -1.9166 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1658 -2.3490 -0.9803 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4055 -1.1946 -0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8223 0.9692 -0.4187 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9356 1.3191 1.1396 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3502 0.1601 1.0713 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1051 1.8965 -0.9442 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0374 3.0932 -1.0571 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2888 3.2708 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4162 -1.1805 1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0391 0.9580 -0.0255 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2834 0.0337 1.5699 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1746 1.4077 1.4949 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0032 -0.7868 -1.0076 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6429 -2.0780 -0.9407 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3813 -0.4854 -1.7099 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 1 0 4 6 1 0 3 7 1 0 7 8 2 0 8 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 4 18 1 0 5 19 1 0 5 20 1 0 5 21 1 0 6 22 1 0 6 23 1 0 6 24 1 0 7 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