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benzonitrile, 3-[(4-oxo-3(4H)-quinazolinyl)methyl]-
SpectraBase Compound ID C7zGGlH1fNk
InChI InChI=1S/C16H11N3O/c17-9-12-4-3-5-13(8-12)10-19-11-18-15-7-2-1-6-14(15)16(19)20/h1-8,11H,10H2
InChIKey INGDPXRFSJLWSL-UHFFFAOYSA-N
Mol Weight 261.28 g/mol
Molecular Formula C16H11N3O
Exact Mass 261.090212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2w8lhQF8M4
Name 3-[(4-oxo-3,4-dihydroquinazolin-3-yl)methyl]benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11N3O
InChI InChI=1S/C16H11N3O/c17-9-12-4-3-5-13(8-12)10-19-11-18-15-7-2-1-6-14(15)16(19)20/h1-8,11H,10H2
InChIKey INGDPXRFSJLWSL-UHFFFAOYSA-N
Molecular Weight 261.284 g/mol
SMILES C1(N(C=Nc2c1cccc2)Cc1cc(C#N)ccc1)=O
SPLASH splash10-03dr-9530000000-6503cb0697211930ee5e
Source of Spectrum IY-2-5126-9
Synonyms Benzonitrile, 3-[[4-oxo-3(4H)-quinazolinyl]methyl]- 3-[(4-oxo-3-quinazolinyl)methyl]benzonitrile 3-[(4-oxoquinazolin-3-yl)methyl]benzonitrile 3-[(4-oxidanylidenequinazolin-3-yl)methyl]benzenecarbonitrile
Wiley ID 1659252