HMDB0031243 RDKit 3D 2-Methylpropanal 13 12 0 0 0 0 0 0 0 0999 V2000 1.3338 -0.1796 -0.3542 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0287 0.0843 0.3945 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 -0.9433 0.0896 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4356 1.4716 0.0456 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1484 1.5414 -0.9384 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9769 0.7120 -0.1453 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7737 -1.0851 0.1355 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1717 -0.3461 -1.4248 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2996 0.0600 1.4795 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7779 -0.6128 -0.6312 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5197 -1.8336 -0.3354 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5455 -1.1759 1.0445 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1412 2.3069 0.6401 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 2 0 1 6 1 0 1 7 1 0 1 8 1 0 2 9 1 0 3 10 1 0 3 11 1 0 3 12 1 0 4 13 1 0 M END