HMDB0038272 RDKit 3D trans-2-Hexenyl propanoate 27 26 0 0 0 0 0 0 0 0999 V2000 3.6705 -0.4673 -0.8144 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5536 -0.1327 0.6377 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3028 -0.6724 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0488 -0.1494 0.7209 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9249 0.7271 -0.2443 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 1.1942 -0.7568 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4664 0.5958 -0.0978 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7539 0.9143 -0.4936 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0219 1.7172 -1.4219 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9151 0.2843 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0926 -1.0938 -0.4545 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7809 -0.9254 -1.2487 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 0.4438 -1.3936 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5434 -1.1693 -1.0059 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 0.9709 0.8242 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4504 -0.5778 1.1561 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3716 -0.4618 2.3958 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3782 -1.7794 1.2359 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1039 -0.5297 1.1436 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7993 1.1425 -0.6889 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5123 2.2891 -0.6574 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4417 0.9450 -1.8335 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7497 0.2084 1.2915 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8352 0.8529 -0.0075 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5015 -1.8373 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7035 -1.0862 -1.4912 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1557 -1.4032 -0.4697 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 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 1 12 1 0 1 13 1 0 1 14 1 0 2 15 1 0 2 16 1 0 3 17 1 0 3 18 1 0 4 19 1 0 5 20 1 0 6 21 1 0 6 22 1 0 10 23 1 0 10 24 1 0 11 25 1 0 11 26 1 0 11 27 1 0 M END