HMDB0032278 RDKit 3D Ethyl trans-2-methyl-2-pentenoate 24 23 0 0 0 0 0 0 0 0999 V2000 -3.8107 -0.5261 0.6838 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9436 -0.0187 -0.4717 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7205 0.6004 0.1278 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 0.1122 -0.1786 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4613 -1.0250 -1.1004 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6907 0.7012 0.3966 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6657 1.6618 1.1782 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9168 0.1589 0.0493 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0997 0.7358 0.6113 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3348 0.0184 0.1218 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8275 -1.6384 0.6428 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3698 -0.2562 1.6655 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8263 -0.0933 0.6476 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4928 0.7820 -1.0283 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7028 -0.8241 -1.1687 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8407 1.4247 0.7908 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8507 -0.7555 -2.1082 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9638 -1.9359 -0.7021 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -1.3051 -1.2471 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0507 0.8093 1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1508 1.7724 0.1765 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1980 -0.1456 -0.9674 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4271 -0.9293 0.6629 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2083 0.6758 0.3445 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 4 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 10 1 0 1 11 1 0 1 12 1 0 1 13 1 0 2 14 1 0 2 15 1 0 3 16 1 0 5 17 1 0 5 18 1 0 5 19 1 0 9 20 1 0 9 21 1 0 10 22 1 0 10 23 1 0 10 24 1 0 M END