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5-(2-Methyl-5-nitro-3-oxo-1,2-dihydro-3H-indazol-1-yl)-3-oxapentyl iodide

View entire compound with spectra: 1 MS (GC)

5-(2-Methyl-5-nitro-3-oxo-1,2-dihydro-3H-indazol-1-yl)-3-oxapentyl iodide
SpectraBase Compound ID AbiP2KPKy6O
InChI InChI=1S/C12H14IN3O4/c1-14-12(17)10-8-9(16(18)19)2-3-11(10)15(14)5-7-20-6-4-13/h2-3,8H,4-7H2,1H3
InChIKey NULVFIGKUZVNSR-UHFFFAOYSA-N
Mol Weight 391.17 g/mol
Molecular Formula C12H14IN3O4
Exact Mass 391.002901 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AFH7lwXo5v4
Name 5-(2-Methyl-5-nitro-3-oxo-1,2-dihydro-3H-indazol-1-yl)-3-oxapentyl iodide
Alternate Name(s) 5-(2-Methyl-5-nitro-3-oxo-1,2-dihydro-3Hindazol-1-yl)-3-oxapentyl iodide 1-(2-(2-iodoethoxy)ethyl)-2-methyl-5-nitro-1H-indazol-3(2H)-one
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Formula C12H14IN3O4
InChI InChI=1S/C12H14IN3O4/c1-14-12(17)10-8-9(16(18)19)2-3-11(10)15(14)5-7-20-6-4-13/h2-3,8H,4-7H2,1H3
InChIKey NULVFIGKUZVNSR-UHFFFAOYSA-N
Molecular Weight 391.165 g/mol
SMILES c12C(N(C)N(c2ccc(N(=O)=O)c1)CCOCCI)=O
SPLASH splash10-0a4l-0977000000-8efcbb0f1b3975c97860
Source of Spectrum EMC-74-131-19
Wiley ID 1739950