Mrv1652309082223362D 14 14 0 0 0 0 999 V2000 1.6335 1.7356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9097 0.9582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 1.4809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2423 1.0353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0331 0.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4121 -0.5822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9665 -1.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1424 -1.2378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6968 -1.9321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8727 -1.8933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4942 -1.1603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9398 -0.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5613 0.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0069 0.9614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 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 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 2 14 1 0 0 0 0 M END > NP0274267 > NP-MRD > O=C1CCCCCCC\C=C/CCO1 > InChI=1S/C12H20O2/c13-12-10-8-6-4-2-1-3-5-7-9-11-14-12/h5,7H,1-4,6,8-11H2/b7-5- > FZKPUQQWULXMCD-ALCCZGGFSA-N > C12H20O2 > 196.29 > 196.146329884 > 1 > 34 > 22.661128859065247 > 1 > 0 > 0 > 1 > (10Z)-1-oxacyclotridec-10-en-2-one > 3.3441789689999997 > 0 > 1 > 0 > -7.033402094039805 > 26.3 > 58.23270000000001 > 0 > 1 > (10Z)-1-oxacyclotridec-10-en-2-one > 1 > NP0274267 > (10z)-1-oxacyclotridec-10-en-2-one $$$$