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6-endo-Chloro-4,5,6,7-tetrahydro-4,7-methano-2-(p-nitrbenzoyl)-5-exo-(p-nitrophenylsulfanyl)-2H-indazole
SpectraBase Compound ID 5B1KrjXBXTm
InChI InChI=1S/C21H15ClN4O5S/c22-17-9-15-16-10-24(21(27)11-1-3-12(4-2-11)25(28)29)23-19(16)18(17)20(15)32-14-7-5-13(6-8-14)26(30)31/h1-8,10,15,17-18,20H,9H2/t15-,17-,18+,20-/m1/s1
InChIKey YFBCTEUHNDCHHS-PHXBYCTMSA-N
Mol Weight 470.89 g/mol
Molecular Formula C21H15ClN4O5S
Exact Mass 470.045168 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5JD4pc8yg4g
Name 6-endo-Chloro-4,5,6,7-tetrahydro-4,7-methano-2-(p-nitrbenzoyl)-5-exo-(p-nitrophenylsulfanyl)-2H-indazole
Alternate Name(s) 6-endo-Chloro-4,5,6,7-tetrahydro-4,7-methano-2-(p-nitrbenzoyl)-5-exo-(p-nitrophenylsulfenyl)-2H-indazole 6-endo-Chloro-4,5,6,7-tetrahydro-4,7-methano-2-(p-nitrobenzoyl)-5-exo-(p-nitrophenylsulfanyl)-2H-indazole 9-Chloro-4-(4-nitrobenzoyl)-10-[(4-nitrophenyl)sulfanyl]-3,4-diazatricyclo[5.2.1.0(2,6)]deca-2,5-diene 9-Chloro-4-(4-nitrobenzoyl)-3,4-diazatricyclo[5.2.1.0(2,6)]deca-2,5-dien-10-yl 4-nitrophenyl sulfide
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Formula C21H15ClN4O5S
InChI InChI=1S/C21H15ClN4O5S/c22-17-9-15-16-10-24(21(27)11-1-3-12(4-2-11)25(28)29)23-19(16)18(17)20(15)32-14-7-5-13(6-8-14)26(30)31/h1-8,10,15,17-18,20H,9H2/t15-,17-,18+,20-/m1/s1
InChIKey YFBCTEUHNDCHHS-PHXBYCTMSA-N
Molecular Weight 470.887 g/mol
SMILES c12c(n[n](c2)C(c2ccc(N(=O)=O)cc2)=O)[C@]2([C@@]([C@@]1(C[C@]2(Cl)[H])[H])(Sc1ccc(N(=O)=O)cc1)[H])[H]
SPLASH splash10-0udi-0911400000-36f2e5a56811b0581e33
Source of Spectrum KC-0-2738-29
Wiley ID 831424