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Methyl N,N'-di(quinolin-3-ylcarbonyl)-imidoselenocarbamate
SpectraBase Compound ID 2h8qC7rzRNJ
InChI InChI=1S/C22H16N4O2Se/c1-29-22(25-20(27)16-10-14-6-2-4-8-18(14)23-12-16)26-21(28)17-11-15-7-3-5-9-19(15)24-13-17/h2-13H,1H3,(H,25,26,27,28)
InChIKey UXKLQFHIHIOUDE-UHFFFAOYSA-N
Mol Weight 447.37 g/mol
Molecular Formula C22H16N4O2Se
Exact Mass 448.043848 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EY5gpteRm7P
Name Methyl N,N'-di(quinolin-3-ylcarbonyl)-imidoselenocarbamate
Alternate Name(s) N,N'-bis[oxo(3-quinolinyl)methyl]carbamimidoselenoic acid methyl ester methyl N,N'-bis(quinoline-3-carbonyl)carbamimidoselenoate N-[C-methylselanyl-N-(quinoline-3-carbonyl)carbonimidoyl]quinoline-3-carboxamide methyl N,N'-bis(quinolin-3-ylcarbonyl)carbamimidoselenoate
Comments Less than 3 mono-isotopic peaks
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Formula C22H16N4O2Se
InChI InChI=1S/C22H16N4O2Se/c1-29-22(25-20(27)16-10-14-6-2-4-8-18(14)23-12-16)26-21(28)17-11-15-7-3-5-9-19(15)24-13-17/h2-13H,1H3,(H,25,26,27,28)
InChIKey UXKLQFHIHIOUDE-UHFFFAOYSA-N
Molecular Weight 447.368 g/mol
SMILES N(\C(=N\C(c1cc2ccccc2nc1)=O)[Se]C)C(c1cc2ccccc2nc1)=O
SPLASH splash10-004i-0900000000-5576a6262edb99fd1ef1
Source of Spectrum F2-46-272-8b
Wiley ID 1689897