8 7 0 0000 0 0 0 0 0999 V2000 1.2127 1.2124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.4253 1.9120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.6380 1.2124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.8506 1.9120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.0633 1.2124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 7.2760 1.9120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.4886 1.2124 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 7.2760 3.3113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 2 0 M END > InChI=1S/C6H12O2/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H,7,8)/i1D3,2D2 > FUZZWVXGSFPDMH-ZBJDZAJPSA-N > 1/1/N:1,3,4,5,6,7,8,9/E:(7,8)/I:/E:m/rA:13nCH.i2CCCCCOOH.i2H.i2H.i2H.i2/rB:s1;s1;s3;s4;s5;s6;s7;d7;s3;s3;s1;s1;/rC:1.2127,1.2124,0;0,1.912,0;2.4253,1.912,0;3.638,1.2124,0;4.8506,1.912,0;6.0633,1.2124,0;7.276,1.912,0;8.4886,1.2124,0;7.276,3.3113,0;3.1253,3.1245,0;1.7253,3.1245,0;.5127,0,0;1.9127,0,0; > C6 H12 O2 > 121.1891 > C([2H])([2H])(C([2H])([2H])CCCC(=O)O)[2H] > 24533631 $$$$