Mrv1652309042205372D 17 16 0 0 0 0 999 V2000 -0.7655 4.4170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2254 3.7933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4955 3.0138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0446 2.3902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8547 2.5461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3948 1.9224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 2.0783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 2.8579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9349 3.4815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 4.2611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0151 4.4170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5552 3.7933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3653 3.9493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9054 3.3256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7155 3.4815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2556 2.8579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0658 3.0138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 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 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 M END > NP0187447 > NP-MRD > CC\C=C/C\C=C/CCCCCCCCC=O > InChI=1S/C16H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h3-4,6-7,16H,2,5,8-15H2,1H3/b4-3-,7-6- > XVUOBZPYNZBZFQ-CWWKMNTPSA-N > C16H28O > 236.399 > 236.214015522 > 1 > 45 > 30.89000391069176 > 0 > 0 > 0 > 1 > (10Z,13Z)-hexadeca-10,13-dienal > 5.374123212000001 > 0 > 0 > 0 > 17.78551400401622 > -6.944305999531455 > 17.07 > 78.39139999999999 > 12 > 0 > (10Z,13Z)-hexadeca-10,13-dienal > 0 > NP0187447 > (10z,13z)-hexadeca-10,13-dienal $$$$