HMDB0061749 RDKit 3D Methyl-tert-butyl ether 18 17 0 0 0 0 0 0 0 0999 V2000 2.0755 -0.3704 0.0225 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 -0.6052 -0.6742 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2143 -0.0674 -0.1822 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2291 1.4253 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6354 -0.6505 1.1663 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3502 -0.4400 -1.1495 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0759 -0.7411 1.0689 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8999 -0.9428 -0.4863 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4233 0.6934 -0.0015 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8546 1.9116 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7246 1.7549 0.8974 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7715 1.8893 -0.0428 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2013 -1.5898 1.0524 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1982 -0.7129 1.8657 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3621 0.0863 1.6047 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6946 -1.4572 -0.8876 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1507 0.3196 -1.1405 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9564 -0.5031 -2.1874 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 3 5 1 0 3 6 1 0 1 7 1 0 1 8 1 0 1 9 1 0 4 10 1 0 4 11 1 0 4 12 1 0 5 13 1 0 5 14 1 0 5 15 1 0 6 16 1 0 6 17 1 0 6 18 1 0 M END