Mrv1533004151517492D 20 22 0 0 0 0 999 V2000 1.7615 3.2195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9336 2.4127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7697 2.1676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9136 1.3280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2454 0.7787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4754 0.3953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3348 -0.4176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9685 -0.9459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7428 -0.6612 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8278 -1.7588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8674 1.0272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0428 1.1081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5052 0.4914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1351 1.9192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8924 2.2465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5799 2.3467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2471 1.8280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7785 1.3601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1161 2.1129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5459 1.6631 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 2 0 0 0 0 8 10 1 0 0 0 0 6 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 2 17 1 0 0 0 0 11 17 1 0 0 0 0 17 18 1 0 0 0 0 5 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 M END > NP0163730 > NP-MRD > CC1CCC2C(OC(C)=O)C3=C(C)C(=O)CC13C2(C)C > InChI=1S/C17H24O3/c1-9-6-7-12-15(20-11(3)18)14-10(2)13(19)8-17(9,14)16(12,4)5/h9,12,15H,6-8H2,1-5H3 > FHGRIGPOCXOGPU-UHFFFAOYSA-N > C17H24O3 > 276.376 > 276.172544633 > 2 > 44 > 30.76485314967639 > 1 > 0 > 0 > 1 > 4,10,11,11-tetramethyl-3-oxotricyclo[5.3.1.0¹,⁵]undec-4-en-6-yl acetate > 3.37 > 2.6784850736666663 > -3.66 > 0 > 3 > 0 > 19.85137391021957 > -6.015868193982502 > 43.370000000000005 > 76.711 > 2 > 1 > 6.06e-02 g/l > 4,10,11,11-tetramethyl-3-oxotricyclo[5.3.1.0¹,⁵]undec-4-en-6-yl acetate > 0 > NP0163730 > 4,10,11,11-tetramethyl-3-oxotricyclo[5.3.1.0¹,⁵]undec-4-en-6-yl acetate $$$$