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3-isopropyl-4-keto-quinazoline-2-carbonitrile
SpectraBase Compound ID LIFaRhMMypj
InChI InChI=1S/C12H11N3O/c1-8(2)15-11(7-13)14-10-6-4-3-5-9(10)12(15)16/h3-6,8H,1-2H3
InChIKey APTXRAOJGKLEAW-UHFFFAOYSA-N
Mol Weight 213.24 g/mol
Molecular Formula C12H11N3O
Exact Mass 213.090212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID TZlALIIDU2
Name 3-isopropyl-4-keto-quinazoline-2-carbonitrile
Alternate Name(s) 3-isopropyl-4-oxo-quinazoline-2-carbonitrile 4-Oxidanylidene-3-propan-2-yl-quinazoline-2-carbonitrile 4-Oxo-3-propan-2-yl-2-quinazolinecarbonitrile 4-Oxo-3-propan-2-ylquinazoline-2-carbonitrile
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Formula C12H11N3O
InChI InChI=1S/C12H11N3O/c1-8(2)15-11(7-13)14-10-6-4-3-5-9(10)12(15)16/h3-6,8H,1-2H3
InChIKey APTXRAOJGKLEAW-UHFFFAOYSA-N
Molecular Weight 213.240 g/mol
SMILES C1(N(C(C#N)=Nc2c1cccc2)C(C)C)=O
SPLASH splash10-00di-0930000000-204ac9ca72b436bca1e7
Source of Spectrum Y-35-660-5
Wiley ID 1212611