Mrv1652309092206512D 12 11 0 0 0 0 999 V2000 2.2836 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 2.5559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7125 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 2.5559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1414 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8559 2.5559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8559 3.3809 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.5704 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5704 1.3184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2849 2.5559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9993 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7138 2.5559 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 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 M END > NP0279455 > NP-MRD > CCCCCC(F)C(=O)OCC > InChI=1S/C9H17FO2/c1-3-5-6-7-8(10)9(11)12-4-2/h8H,3-7H2,1-2H3 > PUSRUYDWHOOYOX-UHFFFAOYSA-N > C9H17FO2 > 176.231 > 176.12125795 > 1 > 29 > 19.64112873667044 > 1 > 0 > 0 > 1 > ethyl 2-fluoroheptanoate > 2.7781926566666666 > 0 > 0 > 0 > -7.460044091804061 > 26.3 > 44.9924 > 7 > 1 > ethyl 2-fluoroheptanoate > 1 > NP0279455 > ethyl 2-fluoroheptanoate $$$$