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稳定性同位素
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苯胺-2,3,4,5,6-d5CAS号 : 4165-61-1分子式: C6D5NH2 分子量: 98.16IUPAC Name: 2,3,4,5,6-pentadeuterioanilineSMILES: C1=CC=C(C=C1)NInChIKey: PAYRUJLWNCNPSJ-RALIUCGRSA-NInChI: InChI=1S/C6H7N/c7-6-4-2-1-3-5-6/h1-5H,7H2/i1D,2D,3D,4D,5D
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2-溴乙醇-1,1,2,2-d4CAS号 : 81764-55-8分子式: BrCD2CD2OH 分子量: 128.99IUPAC Name: 2-bromo-1,1,2,2-tetradeuterioethanolSMILES: C(CBr)OInChIKey: LDLCZOVUSADOIV-LNLMKGTHSA-NInChI: InChI=1S/C2H5BrO/c3-1-2-4/h4H,1-2H2/i1D2,2D2
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硝酸钙-15N2CAS号 : 31432-44-7分子式: Ca(15NO3)2 分子量: 166.07IUPAC Name: calcium;dioxido(oxo)(15N)azaniumSMILES: [N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Ca+2]InChIKey: ZCCIPPOKBCJFDN-IMSGLENWSA-NInChI: InChI=1S/Ca.2NO3/c;2*2-1(3)4/q+2;2*-1/i;2*1+1
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环己醇-d12CAS号 : 66522-78-9分子式: C6D11OD 分子量: 112.23IUPAC Name: 1,1,2,2,3,3,4,4,5,5,6-undecadeuterio-6-deuteriooxycyclohexaneSMILES: [2H]OC1([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C1([2H])[2H]InChIKey: HPXRVTGHNJAIIH-BFHGLDALSA-NInChI: InChI=1S/C6H12O/c7-6-4-2-1-3-5-6/h6-7H,1-5H2/i1D2,2D2,3D2,4D2,5D2,6D,7D
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骨化二醇CAS号 : 19356-17-3分子式: C27H44O2 分子量: 400.64IUPAC Name: (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-olSMILES: CC(CCCC(C)(C)O)C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)O)CInChIKey: JWUBBDSIWDLEOM-DTOXIADCSA-NInChI: InChI=1S/C27H44O2/c1-19-10-13-23(28)18-22(19)12-11-21-9-7-17-27(5)24(14-15-25(21)27)20(2)8-6-16-26(3,4)29/h11-12,20,23-25,28-29H,1,6-10,13-18H2,2-5H3/b21-11+,22-12-/t20-,23+,24-,25+,27-/m1/s1
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骨化二醇-D6CAS号 : 78782-98-6分子式: C27H44O2 分子量: 406.67IUPAC Name: (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-7,7,7-trideuterio-6-hydroxy-6-(trideuteriomethyl)heptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-olSMILES: CC(CCCC(C)(C)O)C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)O)CInChIKey: JWUBBDSIWDLEOM-QFVHMXLQSA-NInChI: InChI=1S/C27H44O2/c1-19-10-13-23(28)18-22(19)12-11-21-9-7-17-27(5)24(14-15-25(21)27)20(2)8-6-16-26(3,4)29/h11-12,20,23-25,28-29H,1,6-10,13-18H2,2-5H3/b21-11+,22-12-/t20-,23+,24-,25+,27-/m1/s1/i3D3,4D3
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胆固醇-d7CAS号 : 83199-47-7分子式: C27H39D7O 分子量: 393.70IUPAC Name: (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6,7,7,7-tetradeuterio-6-(trideuteriomethyl)heptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-olSMILES: CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)CInChIKey: HVYWMOMLDIMFJA-IFAPJKRJSA-NInChI: InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1/i1D3,2D3,18D
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胆甾-5-烯-3,4-二醇-d7CAS号 : 1246302-80-6 Compound CID : 3247052分子式: C27H39D7O2 分子量: 409.696IUPAC Name: (3S,4R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6,7,7,7-tetradeuterio-6-(trideuteriomethyl)heptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,4-diolSMILES: CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4O)O)C)CInChIKey: CZDKQKOAHAICSF-BZNWTYAPSA-NInChI: InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)20-11-12-21-19-9-10-23-25(29)24(28)14-16-27(23,5)22(19)13-15-26(20,21)4/h10,17-22,24-25,28-29H,6-9,11-16H2,1-5H3/t18-,19+,20-,21+,22+,24+,25-,26-,27-/m1/s1/i1D3,2D3,17D
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氘代屈(Chrysene-d12)CAS号 : 1719-03-5分子式: C18D12 分子量: 240.36IUPAC Name: 1,2,3,4,5,6,7,8,9,10,11,12-dodecadeuteriochryseneSMILES: C1=CC=C2C(=C1)C=CC3=C2C=CC4=CC=CC=C43InChIKey: WDECIBYCCFPHNR-AQZSQYOVSA-NInChI: InChI=1S/C18H12/c1-3-7-15-13(5-1)9-11-18-16-8-4-2-6-14(16)10-12-17(15)18/h1-12H/i1D,2D,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D
