Mrv1652304272018242D 9 9 0 0 0 0 999 V2000 1.6500 1.4290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4125 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 1.4290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4125 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 -0.7145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4125 2.1435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 2 4 2 0 0 0 0 2 7 1 0 0 0 0 3 5 1 0 0 0 0 3 7 2 0 0 0 0 4 8 1 0 0 0 0 5 8 2 0 0 0 0 6 7 1 0 0 0 0 6 9 2 0 0 0 0 M END > CDB005478 > CDB > CC(=O)C1=CC=NC=C1 > InChI=1S/C7H7NO/c1-6(9)7-2-4-8-5-3-7/h2-5H,1H3 > WMQUKDQWMMOHSA-UHFFFAOYSA-N > C7H7NO > 121.139 > 121.052763849 > 2 > 16 > 12.361327642995654 > 1 > 0 > 0 > 0 > 1-(pyridin-4-yl)ethan-1-one > 0.44 > 0.3132209076666669 > 0.09 > 0 > 1 > 0 > 15.807908542320707 > 3.1046203481418573 > 29.96 > 34.303900000000006 > 1 > 1 > 1.48e+02 g/l > 4-acetylpyridine > 1 > CDB005478 > 4-Acetylpyridine $$$$