Mrv1533004161501472D 17 19 0 0 0 0 999 V2000 0.8838 -2.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1387 -1.3654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6538 -0.6979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1387 -0.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8838 0.7541 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9233 -0.2854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8371 0.5350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6378 0.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6378 0.9521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3523 -0.2854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1369 -0.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6218 -0.6979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1369 -1.3654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3523 -1.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6378 -1.5229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9233 -1.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8371 -1.9309 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 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 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 10 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 2 16 1 0 0 0 0 6 16 1 0 0 0 0 16 17 1 0 0 0 0 M END > NP0283621 > NP-MRD > CC1CC(=O)C2(C)C(C)C3=C(CC12C)OC=C3 > InChI=1S/C15H20O2/c1-9-7-13(16)15(4)10(2)11-5-6-17-12(11)8-14(9,15)3/h5-6,9-10H,7-8H2,1-4H3 > LJFIDWTVIFBAAF-UHFFFAOYSA-N > C15H20O2 > 232.323 > 232.146329884 > 1 > 37 > 26.22328669703534 > 1 > 0 > 0 > 1 > 4,4a,7,7a-tetramethyl-4H,4aH,5H,6H,7H,7aH,8H-indeno[5,6-b]furan-5-one > 3.82 > 3.3915692323333335 > -3.87 > 0 > 3 > 0 > -2.9015175609524357 > 30.21 > 66.72170000000001 > 0 > 1 > 3.17e-02 g/l > 4,4a,7,7a-tetramethyl-4H,6H,7H,8H-indeno[5,6-b]furan-5-one > 1 > NP0283621 > 4,4a,7,7a-tetramethyl-4h,6h,7h,8h-indeno[5,6-b]furan-5-one $$$$