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5-endo-Chloro-4,5,6,7-tetrahydro-4,7-methano-2-(p-nitrbenzoyl)-6-exo-(p-nitrophenylsulfanyl)-2H-indazole
SpectraBase Compound ID FVmQTXoUojb
InChI InChI=1S/C21H15ClN4O5S/c22-18-15-9-16(20(18)32-14-7-5-13(6-8-14)26(30)31)19-17(15)10-24(23-19)21(27)11-1-3-12(4-2-11)25(28)29/h1-8,10,15-16,18,20H,9H2/t15-,16+,18+,20+/m0/s1
InChIKey ZIAACUXFFPDYFO-IXIUHKBRSA-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 40uUSOxB6HX
Name 5-endo-Chloro-4,5,6,7-tetrahydro-4,7-methano-2-(p-nitrbenzoyl)-6-exo-(p-nitrophenylsulfanyl)-2H-indazole
Alternate Name(s) 5-endo-Chloro-4,5,6,7-tetrahydro-4,7-methano-2-(p-nitrbenzoyl)-6-exo-(p-nitrophenylsulfenyl)-2H-indazole 5-endo-Chloro-4,5,6,7-tetrahydro-4,7-methano-2-(p-nitrobenzoyl)-6-exo-(p-nitrophenylsulfanyl)-2H-indazole 8-Chloro-4-(4-nitrobenzoyl)-3,4-diazatricyclo[5.2.1.0(2,6)]deca-2,5-dien-9-yl 4-nitrophenyl sulfide 8-Chloro-4-(4-nitrobenzoyl)-9-[(4-nitrophenyl)sulfanyl]-3,4-diazatricyclo[5.2.1.0(2,6)]deca-2,5-diene
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Formula C21H15ClN4O5S
InChI InChI=1S/C21H15ClN4O5S/c22-18-15-9-16(20(18)32-14-7-5-13(6-8-14)26(30)31)19-17(15)10-24(23-19)21(27)11-1-3-12(4-2-11)25(28)29/h1-8,10,15-16,18,20H,9H2/t15-,16+,18+,20+/m0/s1
InChIKey ZIAACUXFFPDYFO-IXIUHKBRSA-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(Sc1ccc(N(=O)=O)cc1)[H])(Cl)[H])[H])[H]
SPLASH splash10-0udi-0901100000-8d1f274d3511cf44b4e3
Source of Spectrum KC-0-2738-28
Wiley ID 831425