Mrv1652309062216592D 20 20 0 0 0 0 999 V2000 1.9843 2.0819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 1.2810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3807 0.7090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1733 0.9378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7678 0.3658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5696 -0.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1641 -1.0071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 -0.6639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5788 -1.4647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 -1.6935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1917 -1.1215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3899 -0.3207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3991 -1.3503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1954 -0.7783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0028 0.0226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5917 0.5946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3844 0.3658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3936 1.3954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7954 0.2514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9935 1.0522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 4 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 15 19 1 0 0 0 0 19 20 1 0 0 0 0 2 20 1 0 0 0 0 M END > NP0233407 > NP-MRD > CC(C)C1=C/C=C(C)/CC\C=C(C)\CCC=C(C)CC\1 > InChI=1S/C20H32/c1-16(2)20-14-12-18(4)10-6-8-17(3)9-7-11-19(5)13-15-20/h8,11-12,14,16H,6-7,9-10,13,15H2,1-5H3/b17-8+,18-12+,19-11?,20-14+ > UJUWZMUCEGGBOH-MEJMJVICSA-N > C20H32 > 272.476 > 272.25040103 > 0 > 52 > 34.920392759574796 > 1 > 0 > 0 > 0 > (1E,3E,11E)-1,7,11-trimethyl-4-(propan-2-yl)cyclotetradeca-1,3,7,11-tetraene > 6.481307531333332 > 0 > 1 > 0 > 0.0 > 95.15799999999999 > 1 > 0 > (1E,3E,11E)-4-isopropyl-1,7,11-trimethylcyclotetradeca-1,3,7,11-tetraene > 1 > NP0233407 > (1e,3e,11e)-4-isopropyl-1,7,11-trimethylcyclotetradeca-1,3,7,11-tetraene $$$$