HMDB0032407 RDKit 3D Methyl hexyl ether 24 23 0 0 0 0 0 0 0 0999 V2000 3.2861 -0.4783 0.4678 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1055 -0.0883 -0.4177 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0935 0.6637 0.4228 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1053 1.0916 -0.3597 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8625 -0.0432 -0.9711 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3843 -1.0233 0.0335 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2397 -0.4675 0.9438 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3834 0.1084 0.4159 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9115 -1.2539 -0.0326 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9479 0.3748 0.6775 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8606 -0.8886 1.4144 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4869 0.6083 -1.1875 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6969 -1.0283 -0.8409 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6167 1.5994 0.7572 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8188 0.1137 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2439 1.7405 -1.2129 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7251 1.7450 0.2733 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1379 -0.6006 -1.6118 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6878 0.3487 -1.5977 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5538 -1.5043 0.5899 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9249 -1.8521 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0125 -0.6017 -0.1492 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9833 0.4941 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0678 0.9419 -0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 1 9 1 0 1 10 1 0 1 11 1 0 2 12 1 0 2 13 1 0 3 14 1 0 3 15 1 0 4 16 1 0 4 17 1 0 5 18 1 0 5 19 1 0 6 20 1 0 6 21 1 0 8 22 1 0 8 23 1 0 8 24 1 0 M END