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龙胆紫-d6CAS号 : 1266676-01-0分子式: C25H24D6ClN3 分子量: 414.02IUPAC Name: [4-[bis[4-(dimethylamino)phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-bis(trideuteriomethyl)azanium;chlorideSMILES: CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C.[Cl-]InChIKey: ZXJXZNDDNMQXFV-TXHXQZCNSA-MInChI: InChI=1S/C25H30N3.ClH/c1-26(2)22-13-7-19(8-14-22)25(20-9-15-23(16-10-20)27(3)4)21-11-17-24(18-12-21)28(5)6;/h7-18H,1-6H3;1H/q+1;/p-1/i1D3,2D3;
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西咪替丁-d3（Cimetidine-d3）CAS号 : 1185237-29-9分子式: C10H13D3N6S 分子量: 255.34IUPAC Name: 1-cyano-3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-2-(trideuteriomethyl)guanidineSMILES: CC1=C(N=CN1)CSCCNC(=NC)NC#NInChIKey: AQIXAKUUQRKLND-BMSJAHLVSA-NInChI: InChI=1S/C10H16N6S/c1-8-9(16-7-15-8)5-17-4-3-13-10(12-2)14-6-11/h7H,3-5H2,1-2H3,(H,15,16)(H2,12,13,14)/i2D3
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醛固酮-d7CAS号 : 1261254-31-2分子式: C21D7H21O5 分子量: 367.49SMILES: [2H]C1=C2C([2H])([2H])C[C@H]3[C@@H]4CCC([2H])(C(=O)C(O)([*])[*])[C@]4(C[C@H](O)[C@@H]3[C@@]2(C)CC([2H])([2H])C1=O)C=O
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硫酸铵-d₈CAS号 : 13814-01-2分子式: (ND4)2SO4 分子量: 140.19IUPAC Name: tetradeuterioazanium;sulfateSMILES: [NH4+].[NH4+].[O-]S(=O)(=O)[O-]InChIKey: BFNBIHQBYMNNAN-KTOHAENGSA-NInChI: InChI=1S/2H3N.H2O4S/c;;1-5(2,3)4/h2*1H3;(H2,1,2,3,4)/i/hD8
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1,4-环己二酮-d8CAS号 : 23034-25-5分子式: C6D8O2 分子量: 120.18IUPAC Name: 2,2,3,3,5,5,6,6-octadeuteriocyclohexane-1,4-dioneSMILES: C1CC(=O)CCC1=OInChIKey: DCZFGQYXRKMVFG-SVYQBANQSA-NInChI: InChI=1S/C6H8O2/c7-5-1-2-6(8)4-3-5/h1-4H2/i1D2,2D2,3D2,4D2
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邻苯二甲酸苄基丁基酯-D4CAS号 : 93951-88-3 Compound CID : 16213880分子式: 19H16D4O4IUPAC Name: 2-O-benzyl 1-O-butyl 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylateSMILES: CCCCOC(=O)C1=CC=CC=C1C(=O)OCC2=CC=CC=C2InChIKey: IRIAEXORFWYRCZ-CXRURWBMSA-NInChI: InChI=1S/C19H20O4/c1-2-3-13-22-18(20)16-11-7-8-12-17(16)19(21)23-14-15-9-5-4-6-10-15/h4-12H,2-3,13-14H2,1H3/i7D,8D,11D,12D
