Mrv2104 05262317512D 19 18 0 0 0 0 999 V2000 0.0054 4.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8732 7.7883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5453 4.9493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3814 3.5298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 4.2868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3814 7.1258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3167 4.9493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5619 7.2205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1363 4.8546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0701 6.5580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 5.5171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2506 6.6527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2341 4.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4476 5.4224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9062 5.1385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0536 4.2868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7589 5.9902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9393 6.0849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0867 5.2332 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5 1 1 0 0 0 0 6 2 1 0 0 0 0 7 5 1 0 0 0 0 8 6 1 0 0 0 0 9 7 1 0 0 0 0 10 8 1 0 0 0 0 11 9 1 0 0 0 0 12 10 1 0 0 0 0 14 11 1 0 0 0 0 15 13 1 0 0 0 0 16 3 1 0 0 0 0 16 4 1 0 0 0 0 16 13 1 0 0 0 0 17 12 1 0 0 0 0 18 14 1 0 0 0 0 18 17 1 0 0 0 0 19 15 1 0 0 0 0 19 17 1 0 0 0 0 M END > NP0338411 > NP-MRD > CCCCCCOC(CCCCC)OCCC(C)C > InChI=1/C17H36O2/c1-5-7-9-11-14-18-17(12-10-8-6-2)19-15-13-16(3)4/h16-17H,5-15H2,1-4H3 > BFNIPPNBSJGEQI-UHFFFAOYNA-N > C17H36O2 > 272.473 > 272.271530399 > 2 > 55 > 36.37812574495985 > 0 > 0 > 0 > 0 > 1-(hexyloxy)-1-(3-methylbutoxy)hexane > 6.211741331333332 > 0 > 0 > 0 > -4.01593464602015 > 18.46 > 83.47739999999999 > 14 > 0 > 1-hexoxy-1-isopentyloxy-hexane > 0 > NP0338411 > Hexanal hexyl isoamyl acetal $$$$