Mrv1652304272019162D 11 12 0 0 0 0 999 V2000 0.8250 2.8579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 2.1434 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 -0.7145 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 2.1434 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 -0.4125 -0.7145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 11 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 9 10 1 0 0 0 0 M END > CDB005979 > CDB > CC1=CC2=CC=NC=C2C=C1 > InChI=1S/C10H9N/c1-8-2-3-10-7-11-5-4-9(10)6-8/h2-7H,1H3 > PPEJLOXOMBAXES-UHFFFAOYSA-N > C10H9N > 143.189 > 143.073499294 > 1 > 20 > 16.052437108692843 > 1 > 0 > 0 > 0 > 6-methylisoquinoline > 2.62 > 2.258471535 > -1.90 > 0 > 2 > 0 > 5.900306915487369 > 12.89 > 45.3925 > 0 > 1 > 1.78e+00 g/l > 6-methylisoquinoline > 1 > CDB005979 > 6-Methylisoquinoline $$$$