Mrv1652304272018502D 14 16 0 0 0 0 999 V2000 -3.1394 1.1414 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 -0.4125 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8783 2.1481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5457 2.6330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3857 1.4769 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 -0.9645 1.3276 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 -1.7182 0.9920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2994 2.2974 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 0.1715 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 4 1 0 0 0 0 3 5 1 0 0 0 0 4 9 2 0 0 0 0 5 11 2 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 13 1 0 0 0 0 8 12 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 12 2 0 0 0 0 11 14 1 0 0 0 0 12 14 1 0 0 0 0 M END > CDB005737 > CDB > CC1=NCCC2=C1NC1=CC=CC=C21 > InChI=1S/C12H12N2/c1-8-12-10(6-7-13-8)9-4-2-3-5-11(9)14-12/h2-5,14H,6-7H2,1H3 > CWOYLIJQLSNRRN-UHFFFAOYSA-N > C12H12N2 > 184.2371 > 184.100048394 > 1 > 26 > 21.012017662052266 > 1 > 1 > 0 > 1 > 1-methyl-3H,4H,9H-pyrido[3,4-b]indole > 2.64 > 1.8258825366666662 > -3.31 > 0 > 3 > 1 > 15.035932239124566 > 8.34106427447378 > 28.15 > 57.6882 > 0 > 1 > 9.11e-02 g/l > 1-methyl-3H,4H,9H-pyrido[3,4-b]indole > 1 > CDB005737 > 1-Methyl-4,9-dihydro-3H-beta-carboline $$$$