Mrv1652309052216492D 20 20 0 0 1 0 999 V2000 1.2944 2.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 1.5918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6057 1.6864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0975 1.0240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7696 0.2669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2614 -0.3955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0809 -0.3009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9336 -1.1526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -1.2472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 -2.0043 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2779 -2.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0975 -2.5721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9501 -3.4238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9666 -2.0989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4749 -1.4365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8027 -0.6794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6223 -0.5848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -0.0170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6388 0.7401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4584 0.8347 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 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 6 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 10 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 2 20 1 0 0 0 0 M END > NP0215268 > NP-MRD > CC(C)[C@@H]1CC\C(C)=C\CC\C(C)=C/C\C=C(/C)\C=C\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/h8,10-12,14,16,20H,6-7,9,13,15H2,1-5H3/b14-12+,17-8-,18-10+,19-11+/t20-/m0/s1 > DMHADBQKVWXPPM-ZDXSZPQJSA-N > C20H32 > 272.476 > 272.25040103 > 0 > 52 > 34.89266465384944 > 1 > 0 > 0 > 0 > (1E,3E,6Z,10E,14S)-3,7,11-trimethyl-14-(propan-2-yl)cyclotetradeca-1,3,6,10-tetraene > 6.524965355999999 > 0 > 1 > 0 > 0.0 > 95.4246 > 1 > 0 > (1E,3E,6Z,10E,14S)-14-isopropyl-3,7,11-trimethylcyclotetradeca-1,3,6,10-tetraene > 1 > NP0215268 > (1e,3e,6z,10e,14s)-14-isopropyl-3,7,11-trimethylcyclotetradeca-1,3,6,10-tetraene $$$$