Mrv1652304272018342D 12 12 0 0 0 0 999 V2000 -3.3000 2.8579 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 -2.8875 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0625 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 1.4290 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 0.8250 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4125 -0.7144 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 0.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 0.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 -0.7144 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 12 1 0 0 0 0 9 11 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 M END > CDB005581 > CDB > CCCCCC1=C(C)C=CN=C1 > InChI=1S/C11H17N/c1-3-4-5-6-11-9-12-8-7-10(11)2/h7-9H,3-6H2,1-2H3 > ZITQEYJHBDBSFH-UHFFFAOYSA-N > C11H17N > 163.264 > 163.136099551 > 1 > 29 > 20.344841144179526 > 1 > 0 > 0 > 1 > 4-methyl-3-pentylpyridine > 3.87 > 3.560690827666667 > -2.75 > 0 > 1 > 0 > 6.272095432267533 > 12.89 > 52.3875 > 4 > 1 > 2.93e-01 g/l > 4-methyl-3-pentylpyridine > 1 > CDB005581 > 4-amino-5-butyl-pyridine $$$$