HMDB0032046 RDKit 3D Isopropyl 3-methylbutanoate 26 25 0 0 0 0 0 0 0 0999 V2000 -3.5569 -0.1755 0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 0.4881 0.2997 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5534 1.3071 -0.9013 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2561 -0.6021 0.1288 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0745 -0.1656 -0.3331 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1558 0.6162 -1.3111 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2635 -0.5598 0.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5449 -0.1538 -0.1925 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2856 0.6395 0.8818 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3311 -1.4509 -0.3725 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7144 -0.0136 1.8652 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5439 -1.2820 0.5515 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4487 0.2247 0.2626 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9383 1.1597 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3792 0.8098 -1.8604 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0494 2.3149 -0.8616 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6498 1.5833 -0.8805 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6542 -1.3235 -0.6519 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2243 -1.1828 1.0728 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5449 0.4861 -1.0808 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6297 1.3917 1.3645 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0943 1.2497 0.3773 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8147 -0.0061 1.6033 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7791 -2.1782 -0.9909 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3415 -1.9173 0.6591 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3630 -1.2597 -0.6795 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 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 1 11 1 0 1 12 1 0 1 13 1 0 2 14 1 0 3 15 1 0 3 16 1 0 3 17 1 0 4 18 1 0 4 19 1 0 8 20 1 0 9 21 1 0 9 22 1 0 9 23 1 0 10 24 1 0 10 25 1 0 10 26 1 0 M END