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奎宁盐酸盐二水合物分子式: C20H24N2O2·HCl·2H2O 分子量: 396.91IUPAC Name: (R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;dihydrate;hydrochlorideSMILES: COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O.O.O.ClInChIKey: MPQKYZPYCSTMEI-FLZPLBAKSA-NInChI: InChI=1S/C20H24N2O2.ClH.2H2O/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;;;/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;1H;2*1H2/t13-,14-,19-,20+;;;/m0.../s1
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(R)-(+)-1,1′-联萘-2,2′-二胺CAS号 : 18741-85-0 Compound CID : 20571分子式: H2NC10H6C10H6NH2 分子量: 284.35IUPAC Name: 1-(2-aminonaphthalen-1-yl)naphthalen-2-amineSMILES: C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)N)NInChIKey: DDAPSNKEOHDLKB-UHFFFAOYSA-NInChI: InChI=1S/C20H16N2/c21-17-11-9-13-5-1-3-7-15(13)19(17)20-16-8-4-2-6-14(16)10-12-18(20)22/h1-12H,21-22H2
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(S)-(-)-1,1-二苯基-1,2-丙二醇CAS号 : 46755-94-6 Compound CID : 736300分子式: CH3CH(OH)C(C6H5)2OH 分子量: 228.29IUPAC Name: (2S)-1,1-diphenylpropane-1,2-diolSMILES: CC(C(C1=CC=CC=C1)(C2=CC=CC=C2)O)OInChIKey: RQKXFLUAQLDHMO-LBPRGKRZSA-NInChI: InChI=1S/C15H16O2/c1-12(16)15(17,13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-12,16-17H,1H3/t12-/m0/s1
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(S)-(-)-1,1’-联-2-萘胺CAS号 : 18531-95-8 Compound CID : 20571分子式: H2NC10H6C10H6NH2 分子量: 284.35IUPAC Name: 1-(2-aminonaphthalen-1-yl)naphthalen-2-amineSMILES: C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)N)NInChIKey: DDAPSNKEOHDLKB-UHFFFAOYSA-NInChI: InChI=1S/C20H16N2/c21-17-11-9-13-5-1-3-7-15(13)19(17)20-16-8-4-2-6-14(16)10-12-18(20)22/h1-12H,21-22H2
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(S)-(+)-酮洛芬CAS号 : 22161-81-5 Compound CID : 667550分子式: C6H5COC6H4CH(CH3)CO2H 分子量: 254.28IUPAC Name: (2S)-2-(3-benzoylphenyl)propanoic acidSMILES: CC(C1=CC(=CC=C1)C(=O)C2=CC=CC=C2)C(=O)OInChIKey: DKYWVDODHFEZIM-NSHDSACASA-NInChI: InChI=1S/C16H14O3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,19)/t11-/m0/s1
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(S)-(-)-1-苄基-3-吡咯烷醇CAS号 : 101385-90-4 Compound CID : 2733875分子式: C11H15NO 分子量: 177.24IUPAC Name: (3S)-1-benzylpyrrolidin-3-olSMILES: C1CN(CC1O)CC2=CC=CC=C2InChIKey: YQMXOIAIYXXXEE-NSHDSACASA-NInChI: InChI=1S/C11H15NO/c13-11-6-7-12(9-11)8-10-4-2-1-3-5-10/h1-5,11,13H,6-9H2/t11-/m0/s1
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(R)-(+)-1,1'-联-2-萘酚CAS号 : 18531-94-7 Compound CID : 11762分子式: C20H14O2 分子量: 286.32IUPAC Name: 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-olSMILES: C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)OInChIKey: PPTXVXKCQZKFBN-UHFFFAOYSA-NInChI: InChI=1S/C20H14O2/c21-17-11-9-13-5-1-3-7-15(13)19(17)20-16-8-4-2-6-14(16)10-12-18(20)22/h1-12,21-22H
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(R)-(-)-2-[羟基(二苯基)甲基]-1-甲基吡咯烷CAS号 : 144119-12-0 Compound CID : 853010分子式: C18H21NO 分子量: 267.37IUPAC Name: [(2R)-1-methylpyrrolidin-2-yl]-diphenylmethanolSMILES: CN1CCCC1C(C2=CC=CC=C2)(C3=CC=CC=C3)OInChIKey: XIJAGFLYYNXCAB-QGZVFWFLSA-NInChI: InChI=1S/C18H21NO/c1-19-14-8-13-17(19)18(20,15-9-4-2-5-10-15)16-11-6-3-7-12-16/h2-7,9-12,17,20H,8,13-14H2,1H3/t17-/m1/s1
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(1S,2S)-反式-1,2-环己二醇CAS号 : 57794-08-8 Compound CID : 7057110分子式: C6H12O2 分子量: 116.16IUPAC Name: (1S,2S)-cyclohexane-1,2-diolSMILES: C1CCC(C(C1)O)OInChIKey: PFURGBBHAOXLIO-WDSKDSINSA-NInChI: InChI=1S/C6H12O2/c7-5-3-1-2-4-6(5)8/h5-8H,1-4H2/t5-,6-/m0/s1
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(S)-(-)-(3-氯-2-羟丙基)三甲基氯化铵CAS号 : 101396-91-2 Compound CID : 2793814分子式: ClCH2CH(OH)CH2N(CH3)3Cl 分子量: 188.1IUPAC Name: [(2S)-3-chloro-2-hydroxypropyl]-trimethylazanium;chlorideSMILES: C[N+](C)(C)CC(CCl)O.[Cl-]InChIKey: CSPHGSFZFWKVDL-FYZOBXCZSA-MInChI: InChI=1S/C6H15ClNO.ClH/c1-8(2,3)5-6(9)4-7;/h6,9H,4-5H2,1-3H3;1H/q+1;/p-1/t6-;/m1./s1
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(R)-(+)-α,α-二苯基脯氨醇CAS号 : 22348-32-9 Compound CID : 7045371分子式: C17H19NO 分子量: 253.34IUPAC Name: diphenyl-[(2R)-pyrrolidin-2-yl]methanolSMILES: C1CC(NC1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OInChIKey: OGCGXUGBDJGFFY-MRXNPFEDSA-NInChI: InChI=1S/C17H19NO/c19-17(16-12-7-13-18-16,14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-6,8-11,16,18-19H,7,12-13H2/t16-/m1/s1