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1-(5'-IODOPENTYL)-3-HYDROXY-5-NITROINDAZOLE
SpectraBase Compound ID KfuCLujCZLP
InChI InChI=1S/C12H14IN3O3/c13-6-2-1-3-7-15-11-5-4-9(16(18)19)8-10(11)12(17)14-15/h4-5,8H,1-3,6-7H2,(H,14,17)
InChIKey OGRQBWRBVXIXID-UHFFFAOYSA-N
Mol Weight 375.17 g/mol
Molecular Formula C12H14IN3O3
Exact Mass 375.007986 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1JRInbqNi5k
Name 1-(5-iodanylpentyl)-5-nitro-2H-indazol-3-one
Alternate Name(s) 1-(5-iodopentyl)-5-nitro-2H-indazol-3-one 1-(5-iodopentyl)-5-nitro-indazolin-3-one
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Formula C12H14IN3O3
InChI InChI=1S/C12H14IN3O3/c13-6-2-1-3-7-15-11-5-4-9(16(18)19)8-10(11)12(17)14-15/h4-5,8H,1-3,6-7H2,(H,14,17)
InChIKey OGRQBWRBVXIXID-UHFFFAOYSA-N
Molecular Weight 375.166 g/mol
SMILES Oc1n[n](c2c1cc(cc2)N(=O)=O)CCCCCI
SPLASH splash10-0005-2981000000-f0256035f45d353bd536
Source of Spectrum KC-1993-1125-0
Wiley ID 777975