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四碘荧光素钠盐CAS号 : 16423-68-0 Compound CID : 12961638分子式: C20H6I4Na2O5 分子量: 879.88IUPAC Name: disodium;2',4',5',7'-tetraiodo-3-oxospiro[2-benzofuran-1,9'-xanthene]-3',6'-diolateSMILES: C1=CC=C2C(=C1)C(=O)OC23C4=CC(=C(C(=C4OC5=C(C(=C(C=C35)I)[O-])I)I)[O-])I.[Na+].[Na+]InChIKey: RAGZEDHHTPQLAI-UHFFFAOYSA-LInChI: InChI=1S/C20H8I4O5.2Na/c21-11-5-9-17(13(23)15(11)25)28-18-10(6-12(22)16(26)14(18)24)20(9)8-4-2-1-3-7(8)19(27)29-20;;/h1-6,25-26H;;/q;2*+1/p-2
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(S)-(+)-2-壬醇CAS号 : 70419-06-6 Compound CID : 11094753分子式: CH3(CH2)6CH(OH)CH3 分子量: 144.25IUPAC Name: (2S)-nonan-2-olSMILES: CCCCCCCC(C)OInChIKey: NGDNVOAEIVQRFH-VIFPVBQESA-NInChI: InChI=1S/C9H20O/c1-3-4-5-6-7-8-9(2)10/h9-10H,3-8H2,1-2H3/t9-/m0/s1
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4-氧代-L-脯氨酸氢溴酸盐CAS号 : 75776-67-9 Compound CID : 12773661分子式: C5H7NO3•HBrIUPAC Name: (2S)-4-oxopyrrolidine-2-carboxylic acid;hydrobromideSMILES: C1C(NCC1=O)C(=O)O.BrInChIKey: SFSROLZHCPCODJ-WCCKRBBISA-NInChI: InChI=1S/C5H7NO3.BrH/c7-3-1-4(5(8)9)6-2-3;/h4,6H,1-2H2,(H,8,9);1H/t4-;/m0./s1
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(2S)-N-[((1S,2R)-2-羟基-1,2-二苯乙基]-2-吡咯烷甲酰胺CAS号 : 529486-25-7 Compound CID : 12095457分子式: C19H22N2O2 分子量: 310.4IUPAC Name: (2S)-N-[(1S,2R)-2-hydroxy-1,2-diphenylethyl]pyrrolidine-2-carboxamideSMILES: C1CC(NC1)C(=O)NC(C2=CC=CC=C2)C(C3=CC=CC=C3)OInChIKey: JVOUIFUIIPEWLM-OKZBNKHCSA-NInChI: InChI=1S/C19H22N2O2/c22-18(15-10-5-2-6-11-15)17(14-8-3-1-4-9-14)21-19(23)16-12-7-13-20-16/h1-6,8-11,16-18,20,22H,7,12-13H2,(H,21,23)/t16-,17-,18+/m0/s1
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(2R)-2-氨基-3,3-二甲基-N-2-吡啶基丁酰胺CAS号 : 1568087-94-4 Compound CID : 96403563分子式: C11H17N3O 分子量: 207.3IUPAC Name: (2R)-2-amino-3,3-dimethyl-N-pyridin-2-ylbutanamideSMILES: CC(C)(C)C(C(=O)NC1=CC=CC=N1)NInChIKey: ACNZLRUIGXMARU-VIFPVBQESA-NInChI: InChI=1S/C11H17N3O/c1-11(2,3)9(12)10(15)14-8-6-4-5-7-13-8/h4-7,9H,12H2,1-3H3,(H,13,14,15)/t9-/m0/s1
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N-[3,5-双(三氟甲基)苯基l]-N'-[(1S,2S)-2-(二甲氨基)环己基]脲CAS号 : 1221442-12-1 Compound CID : 71474875分子式: C17H21F6N3O 分子量: 397.4IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[(1S,2S)-2-(dimethylamino)cyclohexyl]ureaSMILES: CN(C)C1CCCCC1NC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)FInChIKey: HXESJOMKFDHHCM-KBPBESRZSA-NInChI: InChI=1S/C17H21F6N3O/c1-26(2)14-6-4-3-5-13(14)25-15(27)24-12-8-10(16(18,19)20)7-11(9-12)17(21,22)23/h7-9,13-14H,3-6H2,1-2H3,(H2,24,25,27)/t13-,14-/m0/s1
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3-[[3,5-双(三氟甲基)苯基]氨基]-4-[[(8a,9S)-6'-甲氧基苯甲酰-9-基]氨基]-3-环丁烯-1,2-二酮CAS号 : 1256245-84-7 Compound CID : 50918013分子式: C32H28F6N4O3 分子量: 630.6IUPAC Name: 3-[3,5-bis(trifluoromethyl)anilino]-4-[[(S)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methyl]amino]cyclobut-3-ene-1,2-dioneSMILES: COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)NC5=C(C(=O)C5=O)NC6=CC(=CC(=C6)C(F)(F)F)C(F)(F)FInChIKey: RWVDHFLTDHDJKH-FRSFCCSCSA-NInChI: InChI=1S/C32H28F6N4O3/c1-3-16-15-42-9-7-17(16)10-25(42)26(22-6-8-39-24-5-4-21(45-2)14-23(22)24)41-28-27(29(43)30(28)44)40-20-12-18(31(33,34)35)11-19(13-20)32(36,37)38/h3-6,8,11-14,16-17,25-26,40-41H,1,7,9-10,15H2,2H3/t16-,17-,25-,26-/m0/s1
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氯代亚硝酰[N,N'-双(3,5-二叔丁基亚水杨基)-1,1,2,2-四甲基乙二胺酸]钌(IV)CAS号 : 386761-71-3 Compound CID : 136631894分子式: C36H54ClN3O3Ru 分子量: 713.37IUPAC Name: chlororuthenium(1+);2,4-ditert-butyl-6-[[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylideneamino]-2,3-dimethylbutan-2-yl]iminomethyl]phenol;nitroxyl anionSMILES: CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)O)C=NC(C)(C)C(C)(C)N=CC2=C(C(=CC(=C2)C(C)(C)C)C(C)(C)C)O.[N-]=O.Cl[Ru+]InChIKey: JLSGLGOKJIQCOY-UHFFFAOYSA-MInChI: InChI=1S/C36H56N2O2.ClH.NO.Ru/c1-31(2,3)25-17-23(29(39)27(19-25)33(7,8)9)21-37-35(13,14)36(15,16)38-22-24-18-26(32(4,5)6)20-28(30(24)40)34(10,11)12;;1-2;/h17-22,39-40H,1-16H3;1H;;/q;;-1;+2/p-1
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(+)-辛可宁分子式: C19H22N2O 分子量: 294.39IUPAC Name: (S)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanolSMILES: C=CC1CN2CCC1CC2C(C3=CC=NC4=CC=CC=C34)OInChIKey: KMPWYEUPVWOPIM-QAMTZSDWSA-NInChI: InChI=1S/C19H22N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18-19,22H,1,8,10-12H2/t13-,14-,18+,19-/m0/s1
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(5S)-2,2,3-三甲基-5-苄基-4-咪唑啉酮单盐酸盐CAS号 : 278173-23-2 Compound CID : 9834882分子式: C13H19ClN2O 分子量: 254.76IUPAC Name: (5S)-5-benzyl-2,2,3-trimethylimidazolidin-4-one;hydrochlorideSMILES: CC1(NC(C(=O)N1C)CC2=CC=CC=C2)C.ClInChIKey: YIYFEXGDFJLJGM-MERQFXBCSA-NInChI: InChI=1S/C13H18N2O.ClH/c1-13(2)14-11(12(16)15(13)3)9-10-7-5-4-6-8-10;/h4-8,11,14H,9H2,1-3H3;1H/t11-;/m0./s1
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P(o-tol)₃ Pd G2CAS号 : 1416422-78-0 Compound CID : 117064986分子式: C33H31ClNPPd 分子量: 614.45IUPAC Name: chloropalladium(1+);2-phenylaniline;tris(2-methylphenyl)phosphaneSMILES: CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C.C1=CC=C([C-]=C1)C2=CC=CC=C2N.Cl[Pd+]InChIKey: HLALSHRZDNLGDQ-UHFFFAOYSA-MInChI: InChI=1S/C21H21P.C12H10N.ClH.Pd/c1-16-10-4-7-13-19(16)22(20-14-8-5-11-17(20)2)21-15-9-6-12-18(21)3;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;;/h4-15H,1-3H3;1-6,8-9H,13H2;1H;/q;-1;;+2/p-1