HMDB0059761 RDKit 3D 4-(1-Methylethyl)-1-cyclohexene-4-carboxaldehyde 27 27 0 0 0 0 0 0 0 0999 V2000 1.6762 1.4894 -0.5019 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9477 0.1909 -0.6295 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9947 -0.9013 -0.7066 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0338 -0.0223 0.5521 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9021 -0.0311 1.7783 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3909 -1.0793 2.1643 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9364 1.1044 0.6663 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8087 1.1317 -0.5613 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3344 -0.0298 -0.9107 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0663 -1.2432 -0.1336 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7157 -1.3045 0.4984 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0518 2.3680 -0.3694 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4911 1.3954 0.2716 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2399 1.6418 -1.4649 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3926 0.1405 -1.5949 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6894 -0.5897 -1.5415 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5927 -1.8708 -0.9951 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6453 -0.9241 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0978 0.8822 2.3218 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6413 0.8474 1.5082 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5123 2.0744 0.9066 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9849 2.0513 -1.1125 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9682 -0.0822 -1.7785 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9005 -1.3222 0.6251 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2442 -2.1436 -0.7932 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8818 -1.6345 1.5668 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1511 -2.1390 0.0362 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 4 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 4 1 0 1 12 1 0 1 13 1 0 1 14 1 0 2 15 1 0 3 16 1 0 3 17 1 0 3 18 1 0 5 19 1 0 7 20 1 0 7 21 1 0 8 22 1 0 9 23 1 0 10 24 1 0 10 25 1 0 11 26 1 0 11 27 1 0 M END