HMDB0033945 RDKit 3D 2-Phenylethyl acetate 24 24 0 0 0 0 0 0 0 0999 V2000 4.8087 0.4025 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4312 0.7291 -0.1775 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2482 1.6321 -1.0365 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3091 0.0742 0.2591 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9994 0.3598 -0.1984 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0359 -0.5484 0.4949 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3622 -0.3987 0.1493 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0145 -1.0725 -0.8607 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3404 -0.8676 -1.1177 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0996 0.0360 -0.3679 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4522 0.7030 0.6326 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1173 0.5027 0.8981 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1285 -0.5721 -0.1097 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7923 0.2436 1.4348 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 1.2208 0.1414 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 0.1552 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8219 1.4181 -0.0561 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -0.4132 1.5916 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3214 -1.6215 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4335 -1.7577 -1.4274 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8197 -1.4094 -1.9132 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1263 0.1456 -0.6229 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0186 1.4208 1.2418 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6897 1.0770 1.7114 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 7 1 0 1 13 1 0 1 14 1 0 1 15 1 0 5 16 1 0 5 17 1 0 6 18 1 0 6 19 1 0 8 20 1 0 9 21 1 0 10 22 1 0 11 23 1 0 12 24 1 0 M END