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1,4-二氨基蒽醌分子式: C14H10N2O2 分子量: 238.25IUPAC Name: 1,4-diaminoanthracene-9,10-dioneSMILES: C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)N)NInChIKey: FBMQNRKSAWNXBT-UHFFFAOYSA-NInChI: InChI=1S/C14H10N2O2/c15-9-5-6-10(16)12-11(9)13(17)7-3-1-2-4-8(7)14(12)18/h1-6H,15-16H2
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IR-775氯化物CAS号 : 199444-11-6 Compound CID : 44465046分子式: C32H36Cl2N2 分子量: 519.55IUPAC Name: (2E)-2-[(2E)-2-[2-chloro-3-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)ethenyl]cyclohex-2-en-1-ylidene]ethylidene]-1,3,3-trimethylindole;chlorideSMILES: CC1(C2=CC=CC=C2[N+](=C1C=CC3=C(C(=CC=C4C(C5=CC=CC=C5N4C)(C)C)CCC3)Cl)C)C.[Cl-]InChIKey: BPSIJFMUSNMMAL-UHFFFAOYSA-MInChI: InChI=1S/C32H36ClN2.ClH/c1-31(2)24-14-7-9-16-26(24)34(5)28(31)20-18-22-12-11-13-23(30(22)33)19-21-29-32(3,4)25-15-8-10-17-27(25)35(29)6;/h7-10,14-21H,11-13H2,1-6H3;1H/q+1;/p-1
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颜料橙43分子式: C26H12N4O2 分子量: 412.41IUPAC Name: 3,10,17,24-tetrazaoctacyclo[13.13.2.02,10.04,9.012,29.016,24.018,23.026,30]triaconta-1(29),2,4,6,8,12,14,16,18,20,22,26(30),27-tridecaene-11,25-dioneSMILES: C1=CC=C2C(=C1)N=C3N2C(=O)C4=CC=C5C6=C(C=CC3=C46)C(=O)N7C5=NC8=CC=CC=C87InChIKey: DGBWPZSGHAXYGK-UHFFFAOYSA-NInChI: InChI=1S/C26H12N4O2/c31-25-15-12-10-14-22-16(26(32)30-20-8-4-2-6-18(20)28-24(14)30)11-9-13(21(15)22)23-27-17-5-1-3-7-19(17)29(23)25/h1-12H
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阴丹酮分子式: C28H14N2O4 分子量: 442.43IUPAC Name: 2,17-diazaheptacyclo[16.12.0.03,16.04,13.06,11.019,28.021,26]triaconta-1(18),3(16),4(13),6,8,10,14,19(28),21,23,25,29-dodecaene-5,12,20,27-tetroneSMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C4=C(C=C3)NC5=C(N4)C=CC6=C5C(=O)C7=CC=CC=C7C6=OInChIKey: UHOKSCJSTAHBSO-UHFFFAOYSA-NInChI: InChI=1S/C28H14N2O4/c31-25-13-5-1-3-7-15(13)27(33)21-17(25)9-11-19-23(21)29-20-12-10-18-22(24(20)30-19)28(34)16-8-4-2-6-14(16)26(18)32/h1-12,29-30H
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三羟甲基丙烷三[3-(氮杂环丙烷-1-基)丙酸酯]CAS号 : 52234-82-9 Compound CID : 93272分子式: C21H35N3O6 分子量: 425.53IUPAC Name: 2,2-bis[3-(aziridin-1-yl)propanoyloxymethyl]butyl 3-(aziridin-1-yl)propanoateSMILES: CCC(COC(=O)CCN1CC1)(COC(=O)CCN2CC2)COC(=O)CCN3CC3InChIKey: KDRBAEZRIDZKRP-UHFFFAOYSA-NInChI: InChI=1S/C21H35N3O6/c1-2-21(15-28-18(25)3-6-22-9-10-22,16-29-19(26)4-7-23-11-12-23)17-30-20(27)5-8-24-13-14-24/h2-17H2,1H3
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1,1,1,3,3,3-六氟-2-丙醇-ODCAS号 : 38701-73-4 Compound CID : 16212653分子式: (CF3)2CHOD 分子量: 169.04IUPAC Name: 2-deuteriooxy-1,1,1,3,3,3-hexafluoropropaneSMILES: C(C(F)(F)F)(C(F)(F)F)OInChIKey: BYEAHWXPCBROCE-MMIHMFRQSA-NInChI: InChI=1S/C3H2F6O/c4-2(5,6)1(10)3(7,8)9/h1,10H/i10D
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1-十六进制-d₃₃-醇CAS号 : 284474-73-3 Compound CID : 71310294分子式: CD3(CD2)14CD2OH 分子量: 275.64IUPAC Name: 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,16-tritriacontadeuteriohexadecan-1-olSMILES: CCCCCCCCCCCCCCCCOInChIKey: BXWNKGSJHAJOGX-TUWMXWROSA-NInChI: InChI=1S/C16H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h17H,2-16H2,1H3/i1D3,2D2,3D2,4D2,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D2,14D2,15D2,16D2
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1-己烷-d₁₃-醇CAS号 : 204244-84-8 Compound CID : 16212921分子式: CD3(CD2)4CD2OH 分子量: 115.25IUPAC Name: 1,1,2,2,3,3,4,4,5,5,6,6,6-tridecadeuteriohexan-1-olSMILES: CCCCCCOInChIKey: ZSIAUFGUXNUGDI-UTBWLCBWSA-NInChI: InChI=1S/C6H14O/c1-2-3-4-5-6-7/h7H,2-6H2,1H3/i1D3,2D2,3D2,4D2,5D2,6D2
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DL-赖氨酸-3,3,4,4,5,5,6,6-d₈ 二盐酸盐CAS号 : 284664-87-5 Compound CID : 16213425分子式: H2N(CD2)4CH(NH2)CO2H·2HCl 分子量: 227.16IUPAC Name: 2,6-diamino-3,3,4,4,5,5,6,6-octadeuteriohexanoic acid;dihydrochlorideSMILES: C(CCN)CC(C(=O)O)N.Cl.ClInChIKey: JBBURJFZIMRPCZ-VHGLFXLXSA-NInChI: InChI=1S/C6H14N2O2.2ClH/c7-4-2-1-3-5(8)6(9)10;;/h5H,1-4,7-8H2,(H,9,10);2*1H/i1D2,2D2,3D2,4D2;;
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