HMDB0037720 RDKit 3D 2-Phenylethyl 2-methylbutanoate 33 33 0 0 0 0 0 0 0 0999 V2000 -3.8171 -1.2417 1.0492 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8962 -1.1703 -0.4398 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0776 -0.0724 -1.0364 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4791 1.2940 -0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6177 -0.2994 -0.8167 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2378 -1.3212 -0.1938 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6587 0.5745 -1.2735 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7195 0.4496 -1.1181 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0752 0.4224 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5645 0.2876 0.4644 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3906 1.4036 0.5142 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7613 1.2888 0.6166 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3606 0.0482 0.6735 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5668 -1.0794 0.6262 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1803 -0.9449 0.5224 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9606 -0.2290 1.5061 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9105 -1.7497 1.3816 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6798 -1.8636 1.3981 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4995 -2.1346 -0.8414 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9438 -1.0650 -0.7467 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2496 -0.0851 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5134 1.5060 -0.8969 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8339 2.0304 -1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3122 1.4714 0.5065 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1889 1.3747 -1.5457 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1787 -0.3931 -1.6569 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8261 1.3751 0.8576 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6305 -0.4358 0.8809 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 2.3648 0.4667 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3517 2.1925 0.6511 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4310 -0.0864 0.7539 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0313 -2.0656 0.6706 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5507 -1.8465 0.4850 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 3 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 10 1 0 1 16 1 0 1 17 1 0 1 18 1 0 2 19 1 0 2 20 1 0 3 21 1 0 4 22 1 0 4 23 1 0 4 24 1 0 8 25 1 0 8 26 1 0 9 27 1 0 9 28 1 0 11 29 1 0 12 30 1 0 13 31 1 0 14 32 1 0 15 33 1 0 M END