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(2-Amino-3, 5-diiodophenyl) (benzotriazole-1-yl)methanone
SpectraBase Compound ID 5J24BPuPFwT
InChI InChI=1S/C13H8I2N4O/c14-7-5-8(12(16)9(15)6-7)13(20)19-11-4-2-1-3-10(11)17-18-19/h1-6H,16H2
InChIKey KDZXOFRBLITYEC-UHFFFAOYSA-N
Mol Weight 490.04 g/mol
Molecular Formula C13H8I2N4O
Exact Mass 489.878751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CxO2JmQkiOk
Name (2-Amino-3, 5-diiodophenyl) (benzotriazole-1-yl)methanone
Appearance Yellow solid
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Formula C13H8I2N4O
InChI InChI=1S/C13H8I2N4O/c14-7-5-8(12(16)9(15)6-7)13(20)19-11-4-2-1-3-10(11)17-18-19/h1-6H,16H2
InChIKey KDZXOFRBLITYEC-UHFFFAOYSA-N
Instrument Name Thermo Finnigan PolarisQ
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0013.818
Molecular Weight 490.043 g/mol
SMILES Nc1c(cc(cc1I)I)C(=O)[n]1c2c(nn1)cccc2
SPLASH splash10-08mi-2297700000-6ffec4a07960f3a9a685
Source of Spectrum ARK-2012-SM21-2m
Wiley ID 1864772