2119 Marvin 12300703363D 41 41 0 0 1 0 999 V2000 -0.0799 1.2718 -1.3861 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -1.5116 -0.9276 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0634 -2.3344 1.3570 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1699 -0.5555 -0.2231 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4116 -1.0194 1.2322 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3108 -2.8096 2.7426 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4758 0.8253 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1587 -4.0977 2.6445 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0139 -3.0387 3.5661 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5866 2.3452 -1.5132 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0077 2.3211 -1.5161 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7821 1.0454 -1.5223 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1194 3.5670 -1.5487 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6864 3.5632 -1.4916 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5792 4.7843 -1.5272 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9837 4.7820 -1.4876 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 0.5178 -2.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4218 -0.6356 -3.3093 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1225 -0.4676 -0.7518 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0190 -0.2737 1.7537 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4342 -1.0704 1.7158 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9186 -2.0658 3.2687 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9773 -2.2378 0.9074 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1627 1.5436 0.2754 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3962 0.7479 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0911 -3.9034 2.1102 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4172 -4.4653 3.6393 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6137 -4.8816 2.1144 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2349 -3.4855 4.5361 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3244 -3.6907 3.0262 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5024 -2.0971 3.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4596 -1.5882 -0.4238 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7857 1.1878 -1.1135 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3311 0.3144 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1435 3.5776 -1.5622 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7083 3.5956 -1.4717 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 5.6680 -1.5284 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4923 5.6677 -1.4555 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4675 1.0590 -3.5072 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5777 -0.9274 -4.2456 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8799 -1.2279 -2.7261 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 10 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 19 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 22 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 17 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 15 1 0 0 0 0 13 35 1 0 0 0 0 14 16 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 M END > 10 11 8 10 13 8 11 14 8 13 15 8 14 16 8 15 16 8 4 2 3 > InChI=1S/C15H23NO2/c1-4-7-13-8-5-6-9-15(13)18-11-14(17)10-16-12(2)3/h4-6,8-9,12,14,16-17H,1,7,10-11H2,2-3H3/t14-/m0/s1 > PAZJSJFMUHDSTF-AWEZNQCLSA-N > 1/0/N:18,8,9,17,16,15,12,14,13,5,7,6,11,4,10,3,2,1/E:(2,3)/it:im/rA:41cOONCCCCCCCCCCCCCCCHHHHHHHHHHHHHHHHHHHHHHH/rB:;;s2;s3s4;s3;s1s4;s6;s6;s1;s10;s11;d10;d11;s13;s14d15;s12;d17;s4;s5;s5;s6;s3;s7;s7;s8;s8;s8;s9;s9;s9;s2;s12;s12;s13;s14;s15;s16;s17;s18;s18;/rC:-.0799,1.2718,-1.3861;-.378,-1.5116,-.9276;-2.0634,-2.3344,1.357;-1.1699,-.5555,-.2231;-1.4116,-1.0194,1.2322;-2.3108,-2.8096,2.7426;-.4758,.8253,-.186;-3.1587,-4.0977,2.6445;-1.0139,-3.0387,3.5661;.5866,2.3452,-1.5132;2.0077,2.3211,-1.5161;2.7821,1.0454,-1.5223;-.1194,3.567,-1.5487;2.6864,3.5632,-1.4916;.5792,4.7843,-1.5272;1.9837,4.782,-1.4876;2.932,.5178,-2.866;2.4218,-.6356,-3.3093;-2.1225,-.4676,-.7518;-2.019,-.2737,1.7537;-.4342,-1.0704,1.7158;-2.9186,-2.0658,3.2687;-2.9773,-2.2378,.9074;-1.1627,1.5436,.2754;.3962,.7479,.475;-4.0911,-3.9034,2.1102;-3.4172,-4.4653,3.6393;-2.6137,-4.8816,2.1144;-1.2349,-3.4855,4.5361;-.3244,-3.6907,3.0262;-.5024,-2.0971,3.773;.4596,-1.5882,-.4238;3.7857,1.1878,-1.1135;2.3311,.3144,-.847;-1.1435,3.5776,-1.5622;3.7083,3.5956,-1.4717;.065,5.668,-1.5284;2.4923,5.6677,-1.4555;3.4675,1.059,-3.5072;2.5777,-.9274,-4.2456;1.8799,-1.2279,-2.7261; > C15 H23 N O2 > 249.3486 > O(C1=C([H])C([H])=C([H])C([H])=C1C([H])([H])C([H])=C([H])[H])C([H])([H])[C@]([H])(C([H])([H])[N@]([H])C([H])(C([H])([H])[H])C([H])([H])[H])O[H] > 2035 $$$$