7 6 0 0000 0 0 0 0 0999 V2000 0.0000 -2.3016 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 1.3304 -2.3016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.9956 -1.1508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.3260 -1.1508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.9912 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.3216 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.6520 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 3 0 M END > InChI=1S/C6H9Br/c1-2-3-4-5-6-7/h1H,3-6H2 > WDNFOERVYIUQPG-UHFFFAOYSA-N > 1/0/N:7,6,5,4,3,2,1/rA:7nBrCCCCCC/rB:s1;s2;s3;s4;s5;t6;/rC:0,-2.3016,0;1.3304,-2.3016,0;1.9956,-1.1508,0;3.326,-1.1508,0;3.9912,0,0;5.3216,0,0;6.652,0,0; > C6 H9 Br > 161.0397 > BrCCCCC#C > 507860 $$$$