HMDB0040212 RDKit 3D 2-Hexenyl acetate 24 23 0 0 0 0 0 0 0 0999 V2000 -4.0753 0.7330 0.5463 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0016 -0.2278 0.0894 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7423 0.5887 -0.2122 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 -0.3741 -0.6593 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4312 -0.4708 0.0306 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4538 -1.4421 -0.4411 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6403 -0.7386 -0.7427 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2479 -0.0334 0.2799 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5100 0.7009 -0.0929 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8225 0.0247 1.4496 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6812 0.2911 1.3669 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6157 1.6921 0.9046 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7402 1.0097 -0.2836 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2746 -0.7710 -0.8361 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8209 -0.9536 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9314 1.2734 -1.0469 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4096 1.1240 0.7006 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9062 -0.9696 -1.5449 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 0.1558 0.9033 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7188 -2.1188 0.4122 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0808 -2.0257 -1.2905 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2453 1.7528 -0.2636 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0004 0.2167 -0.9618 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1840 0.5625 0.7970 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 1 0 8 10 2 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 3 17 1 0 4 18 1 0 5 19 1 0 6 20 1 0 6 21 1 0 9 22 1 0 9 23 1 0 9 24 1 0 M END