Mol:LBF192nnXX01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 21 21 0 0 0 0 0 0 0 0999 V2000 0.5686 -0.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1542 -0.0831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7373 -0.6662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3203 -0.0831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9033 -0.6662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4863 -0.0831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0692 -0.6662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7856 -0.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5034 -0.6648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7842 0.5741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0145 -0.0488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8395 -0.0488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4225 -0.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0055 -0.0488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5884 -0.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1714 -0.0488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7545 -0.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3375 -0.0488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9205 -0.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5034 -0.0488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 0.6662 0.0000 C 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 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 11 1 1 0 0 0 0 11 12 2 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 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 11 21 1 0 0 0 0 12 21 1 0 0 0 0 S SKP 5 ID LBF192nnXX01 FORMULA C19H34O2 EXACTMASS 294.255880332 AVERAGEMASS 294.47206000000006 SMILES C(=C(CCCCCCCC(O)=O)1)(CCCCCCCC)C1 M END