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3-Benzyl-4-keto-quinazoline-2-carbonitrile
SpectraBase Compound ID FIZHOanbwm
InChI InChI=1S/C16H11N3O/c17-10-15-18-14-9-5-4-8-13(14)16(20)19(15)11-12-6-2-1-3-7-12/h1-9H,11H2
InChIKey NHUVEJRIVBXMPF-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 B2RDcWKu4ab
Name 3-Benzyl-4-keto-quinazoline-2-carbonitrile
Alternate Name(s) 3-Benzyl-4-oxo-quinazoline-2-carbonitrile 4-Oxidanylidene-3-(phenylmethyl)quinazoline-2-carbonitrile 4-Oxo-3-(phenylmethyl)-2-quinazolinecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11N3O
InChI InChI=1S/C16H11N3O/c17-10-15-18-14-9-5-4-8-13(14)16(20)19(15)11-12-6-2-1-3-7-12/h1-9H,11H2
InChIKey NHUVEJRIVBXMPF-UHFFFAOYSA-N
Molecular Weight 261.284 g/mol
SMILES C1(N(C(=Nc2ccccc12)C#N)Cc1ccccc1)=O
SPLASH splash10-01ox-6090000000-a35de29a3e1361cabe91
Source of Spectrum Y-35-660-5
Wiley ID 1264892