Mrv1533004241514242D 20 22 0 0 0 0 999 V2000 3.2974 -0.7063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6468 -0.1990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8751 -0.5613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1231 -0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9551 0.6954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6568 0.9665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2793 1.3552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5975 1.9438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8229 1.5462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3659 2.2331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0014 1.5123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8793 1.9683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6971 2.7729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6579 1.6834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6176 0.8587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8109 0.6415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3455 2.1394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0841 1.7719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7717 2.2279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1353 0.9485 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 7 8 1 0 0 0 0 8 9 1 0 0 0 0 5 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 7 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 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 7 16 1 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M END > NP0316409 > NP-MRD > CC1C(CC2C(C)CCC3CC12OC3(C)C)OC(C)=O > InChI=1S/C17H28O3/c1-10-6-7-13-9-17(20-16(13,4)5)11(2)15(8-14(10)17)19-12(3)18/h10-11,13-15H,6-9H2,1-5H3 > WNFIZKASLLDALW-UHFFFAOYSA-N > C17H28O3 > 280.408 > 280.203844762 > 2 > 48 > 32.332602148505934 > 1 > 0 > 0 > 1 > 2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.0¹,⁵]dodecan-3-yl acetate > 3.34 > 2.9647131229999992 > -4.80 > 0 > 3 > 0 > -4.211818794140945 > 35.53 > 77.3977 > 2 > 1 > 4.43e-03 g/l > 2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.0¹,⁵]dodecan-3-yl acetate > 1 > NP0316409 > 2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.0¹,⁵]dodecan-3-yl acetate $$$$