{"Aliases":["Schembl5230184","Q5003182"],"ChemicalClasses":["amphetamine"],"Chirality":"racemic","EliminationHalfLife":"","Erowid Experience Reports":[],"Esters":[],"Formating":[],"HeavyAtomCount":19,"IUPACName":"2-butyl-3-(4-methylphenyl)-1-azabicyclo[2.2.2]octane","InChI":"InChI=1S/C18H27N/c1-3-4-5-17-18(15-8-6-14(2)7-9-15)16-10-12-19(17)13-11-16/h6-9,16-18H,3-5,10-13H2,1-2H3","InChIKey":"QYIZEJQSBLRXJK-UHFFFAOYSA-N","MeSH Headers":[],"MolecularFormula":"C\u003csub\u003e18\u003c/sub\u003eH\u003csub\u003e27\u003c/sub\u003eN","MolecularWeight":"257.4 g/mol","PubChemId":9838015,"RefCount":2,"RefCur":"","References":[{"Name":"Wikipedia","Urls":[{"Link":"https://en.wikipedia.org/wiki/Butyltolylquinuclidine","Name":"Butyltolylquinuclidine","Sub":false}]},{"Name":"PubChem","Urls":[{"Link":"https://pubchem.ncbi.nlm.nih.gov/compound/9838015","Name":"Butyltolylquinuclidine","Sub":false}]}],"Refs":["National Center for Biotechnology Information. PubChem Compound Summary for CID 9838015, Butyltolylquinuclidine. Accessed May 8, 2026. \u003ca href=https://pubchem.ncbi.nlm.nih.gov/compound/9838015\u003ehttps://pubchem.ncbi.nlm.nih.gov/compound/9838015\u003c/a\u003e"],"SMILES":"CCCCC1C(C2CCN1CC2)C3=CC=C(C=C3)C","SaltData":[],"Salts":[],"Scheduling":[],"StereoisomerData":[{"SMILES":"CCCC[C@@H]1[C@@H](C2=CC=C(C)C=C2)[C@H]2CC[N@]1CC2","Title":"(4R,5R)-6S)-9S)-Butyltolylquinuclidine"},{"SMILES":"CCCC[C@H]1[C@@H](C2=CC=C(C)C=C2)[C@H]2CC[N@]1CC2","Title":"(4S,5R)-6R)-9S)-Butyltolylquinuclidine"},{"SMILES":"CCCC[C@@H]1[C@H](C2=CC=C(C)C=C2)[C@H]2CC[N@]1CC2","Title":"(4R,5S)-6S)-9R)-Butyltolylquinuclidine"},{"SMILES":"CCCC[C@H]1[C@H](C2=CC=C(C)C=C2)[C@H]2CC[N@]1CC2","Title":"(4S,5S)-6R)-9R)-Butyltolylquinuclidine"}],"StereoisomerType":"diastereomer","Stereoisomers":["(4R,5R)-6S)-9S)-Butyltolylquinuclidine","(4S,5R)-6R)-9S)-Butyltolylquinuclidine","(4R,5S)-6S)-9R)-Butyltolylquinuclidine","(4S,5S)-6R)-9R)-Butyltolylquinuclidine"],"Structure":"\u003csvg xmlns=\"http://www.w3.org/2000/svg\" preserveAspectRatio=\"none\" style=\"display:block\" viewBox=\"0 0 112.64 62.446\"\u003e\u003crect width=\"100%\" height=\"100%\" fill=\"#fff\"/\u003e\u003cdesc\u003eGenerated by the Chemistry Development Kit (http://github.com/cdk)\u003c/desc\u003e\u003cg stroke=\"#000\" stroke-linecap=\"round\" stroke-linejoin=\"round\" stroke-width=\".7\"\u003e\u003cpath fill=\"#fff\" stroke=\"none\" d=\"M0 0h113v63H0z\"/\u003e\u003cg class=\"mol\"\u003e\u003cpath d=\"m111.729 61.332-15.24.075M96.489 61.407l-7.686-13.16M88.803 48.247l-15.239.076M73.564 48.323l-7.686-13.16M65.878 35.163l-12.047-7.737M53.831 27.426l-.709-14.982M53.122 12.444 37.479 7.007M37.479 7.007l8.731 8.305\" class=\"bond\"/\u003e\u003cpath stroke=\"none\" d=\"M61.696 19.54a.3.3 0 0 1-.069-.009l-7.31-1.829-.043-.733 7.523 1.883q.041-.04.078-.039c.128 0 .212.322.176.464-.037.147-.201.263-.355.263m-9.348-2.331-6.223-1.558c-.17-.042-.297-.254-.255-.424.037-.148.202-.263.356-.263q.035 0 .069.008l6.01 1.505z\" class=\"bond\"/\u003e\u003cpath d=\"m65.878 35.163-.647-11.298M67.933 17.044l8.895-9.054M76.828 7.99 64.61 1.055M53.122 12.444 64.61 1.055M53.831 27.426l-13.198 7.62\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"M40.633 35.046 27.43 27.418M38.195 36.454l-10.766-6.221\"/\u003e\u003c/g\u003e\u003cpath d=\"m27.43 27.418-13.198 7.62\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m14.232 35.038.004 15.248M16.67 36.445l.004 12.433\"/\u003e\u003c/g\u003e\u003cpath d=\"m14.236 50.286 13.204 7.628\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m27.44 57.914 13.198-7.62M27.44 55.099l10.759-6.212\"/\u003e\u003c/g\u003e\u003cpath d=\"m40.633 35.046.005 15.248M14.236 50.286l-13.198 7.62\" class=\"bond\"/\u003e\u003cpath fill=\"#3050f8\" stroke=\"none\" d=\"M66.952 22.467h-.721l-2.619-4.066h-.03l.03.596q.024.357.024.732v2.738h-.566v-4.899h.714l2.608 4.054h.03l-.018-.327-.024-.477q-.006-.262-.006-.482v-2.768h.578z\" class=\"atom\"/\u003e\u003cpath stroke=\"#3050f8\" d=\"m65.231 23.865.323 5.649M67.933 17.044l4.448-4.527\" class=\"hi\"/\u003e\u003c/g\u003e\u003c/g\u003e\u003c/svg\u003e","Title":"Butyltolylquinuclidine","Wikipedia":"Butyltolylquinuclidine","XLogP":4.8}