Mrv1652308221903562D 13 14 0 0 0 0 999 V2000 3.5749 -3.0221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0598 -2.3547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7544 -2.9359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7243 -1.6010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4189 -2.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8781 -0.0937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1331 0.6910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5682 -0.7611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9038 -1.5148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0531 -0.0937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4656 1.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4656 2.0009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7982 0.6910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 3 1 1 0 0 0 0 4 2 1 0 0 0 0 5 3 2 0 0 0 0 7 6 1 0 0 0 0 9 4 2 0 0 0 0 9 5 1 0 0 0 0 9 8 1 0 0 0 0 10 6 1 0 0 0 0 10 8 1 0 0 0 0 11 7 1 0 0 0 0 12 11 2 0 0 0 0 13 10 1 0 0 0 0 13 11 1 0 0 0 0 M END > NP0240250 > NP-MRD > O=C1CCC(CC2=CC=CC=C2)O1 > InChI=1S/C11H12O2/c12-11-7-6-10(13-11)8-9-4-2-1-3-5-9/h1-5,10H,6-8H2 > OJKCYERWEGKEIS-UHFFFAOYSA-N > C11H12O2 > 176.215 > 176.083729626 > 1 > 25 > 18.864564779896217 > 1 > 0 > 0 > 1 > 5-benzyloxolan-2-one > 2.33 > 2.2224526979999997 > -3.00 > 0 > 2 > 0 > -7.043276940854531 > 26.3 > 49.34590000000001 > 2 > 1 > 1.75e-01 g/l > 5-benzyloxolan-2-one > 1 > NP0240250 > 5-benzyloxolan-2-one $$$$