HMDB0036208 RDKit 3D 2-Propenyl 2-ethylbutanoate 27 26 0 0 0 0 0 0 0 0999 V2000 4.6452 0.5251 0.4171 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7094 -0.0752 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6048 -0.8528 0.3135 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3931 -0.2528 -0.0713 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1432 -0.6638 0.2916 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -1.6692 1.0385 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0852 0.0363 -0.1662 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3408 -0.5934 0.3587 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5261 -2.0122 -0.0468 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9708 1.4673 0.3197 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1949 2.2259 -0.1184 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6324 0.4655 1.5181 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4566 1.0943 0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7965 0.0337 -1.3926 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6354 -1.9240 0.0223 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7751 -0.8276 1.4076 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1084 0.0625 -1.2816 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2044 0.0091 0.0109 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3241 -0.4675 1.4742 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7058 -2.2825 -0.7527 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4882 -2.1514 -0.6011 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4933 -2.7110 0.8061 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8453 1.4805 1.4305 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0467 1.8833 -0.1436 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5054 1.9296 -1.1189 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9766 3.3189 -0.0593 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0129 1.9511 0.6055 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 7 10 1 0 10 11 1 0 1 12 1 0 1 13 1 0 2 14 1 0 3 15 1 0 3 16 1 0 7 17 1 0 8 18 1 0 8 19 1 0 9 20 1 0 9 21 1 0 9 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