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2-{3'-[(2",2"-Dimethylpropanoyl)]selenoureido}-benzonitrile
SpectraBase Compound ID JBkc746mlEp
InChI InChI=1S/C13H15N3OSe/c1-13(2,3)11(17)16-12(18)15-10-7-5-4-6-9(10)8-14/h4-7H,1-3H3,(H2,15,16,17,18)
InChIKey XAJSBDAZGWFCGI-UHFFFAOYSA-N
Mol Weight 308.25 g/mol
Molecular Formula C13H15N3OSe
Exact Mass 309.038034 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LAuv7QmE48q
Name 2-{3'-[(2",2"-Dimethylpropanoyl)]selenoureido}-benzonitrile
Alternate Name(s) 2-{3'-[(2'',2''-Dimethylpropanoyl)]selenoureido}-benzonitrile N-(2-cyanophenyl)-N'-(2,2-dimethylpropanoyl)selenourea
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Formula C13H15N3OSe
InChI InChI=1S/C13H15N3OSe/c1-13(2,3)11(17)16-12(18)15-10-7-5-4-6-9(10)8-14/h4-7H,1-3H3,(H2,15,16,17,18)
InChIKey XAJSBDAZGWFCGI-UHFFFAOYSA-N
Molecular Weight 308.255 g/mol
SMILES N(C(Nc1c(C#N)cccc1)=[Se])C(C(C)(C)C)=O
SPLASH splash10-00b9-7392000000-eeb1651b8c63d1d847ce
Source of Spectrum G-64-1688-5
Wiley ID 749579