HMDB0032313 RDKit 3D 2,4-Hexadienyl isobutyrate 28 27 0 0 0 0 0 0 0 0999 V2000 3.3252 4.0655 2.7938 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0546 3.4168 2.3749 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0302 2.1411 2.0655 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7965 1.4785 1.6511 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7406 0.1992 1.3342 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4672 -0.5161 0.9126 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3582 -1.0791 -0.3787 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4422 -1.7870 -0.8968 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4603 -1.8762 -0.1639 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4249 -2.4112 -2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2035 -1.4162 -3.3391 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 -3.0620 -2.4675 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1534 5.0541 3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0463 4.1795 1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8007 3.4146 3.5745 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1607 4.0073 2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9665 1.6029 2.1317 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1187 2.0486 1.5968 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6635 -0.3616 1.3922 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3734 0.1321 0.8932 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6775 -1.2959 1.6817 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6568 -3.2296 -2.2839 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6303 -0.4366 -2.9942 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1291 -1.2224 -3.5331 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7372 -1.7732 -4.2359 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0122 -3.1751 -3.5395 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5466 -2.4929 -1.9068 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7299 -4.0652 -1.9769 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 2 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 10 12 1 0 1 13 1 0 1 14 1 0 1 15 1 0 2 16 1 0 3 17 1 0 4 18 1 0 5 19 1 0 6 20 1 0 6 21 1 0 10 22 1 0 11 23 1 0 11 24 1 0 11 25 1 0 12 26 1 0 12 27 1 0 12 28 1 0 M END