Mrv1652309052212242D 14 14 0 0 0 0 999 V2000 -1.4289 4.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 4.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 4.9500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 3.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 3.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 1.2375 0.0000 O 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 2 4 1 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 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 8 13 1 0 0 0 0 13 14 1 0 0 0 0 M END > NP0211921 > NP-MRD > CC(=O)OC\C=C\C1=CC=CC=C1O > InChI=1S/C11H12O3/c1-9(12)14-8-4-6-10-5-2-3-7-11(10)13/h2-7,13H,8H2,1H3/b6-4+ > LVVKBEYERXTDCU-GQCTYLIASA-N > C11H12O3 > 192.214 > 192.078644246 > 2 > 26 > 20.545317491660985 > 1 > 1 > 0 > 1 > (2E)-3-(2-hydroxyphenyl)prop-2-en-1-yl acetate > 1.9533718106666662 > 0 > 1 > 0 > 9.343562100019266 > -6.036142487726072 > 46.53 > 54.32490000000002 > 4 > 1 > (2E)-3-(2-hydroxyphenyl)prop-2-en-1-yl acetate > 0 > NP0211921 > (2e)-3-(2-hydroxyphenyl)prop-2-en-1-yl acetate $$$$