HMDB0030063 RDKit 3D Benzyl propionate 24 24 0 0 0 0 0 0 0 0999 V2000 4.0145 0.3115 0.1096 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7358 1.1330 -0.0992 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6023 0.2020 0.0362 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1984 -0.1023 1.1708 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0047 -0.3190 -1.0811 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0845 -1.2155 -1.0462 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2775 -0.6554 -0.3802 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6177 -0.9839 0.9151 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7422 -0.4364 1.5057 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5663 0.4487 0.8455 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2428 0.7880 -0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1225 0.2425 -1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4206 0.1087 -0.9217 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7348 0.8270 0.7484 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8023 -0.6759 0.5422 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7195 1.6210 -1.0881 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6473 1.8998 0.7246 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3139 -1.4761 -2.1142 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2236 -2.1723 -0.5539 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0138 -1.6806 1.5009 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9912 -0.7014 2.5092 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4433 0.8713 1.3165 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8674 1.4870 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 0.4784 -2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 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 2 16 1 0 2 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