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2-Quinazolinecarbonitrile, 1-benzoyl-1,2-dihydro-4-phenyl-2-(phenylmethyl)-
SpectraBase Compound ID EmYKwZmZ3ub
InChI InChI=1S/C29H21N3O/c30-21-29(20-22-12-4-1-5-13-22)31-27(23-14-6-2-7-15-23)25-18-10-11-19-26(25)32(29)28(33)24-16-8-3-9-17-24/h1-19H,20H2
InChIKey LPTXKBCGSAXSLI-UHFFFAOYSA-N
Mol Weight 427.51 g/mol
Molecular Formula C29H21N3O
Exact Mass 427.168462 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HN7PW7k5rsV
Name 2-Quinazolinecarbonitrile, 1-benzoyl-1,2-dihydro-4-phenyl-2-(phenylmethyl)-
Alternate Name(s) 1-Benzoyl-2-benzyl-1,2-dihydro-4-phenylquinazoline-2-carbonitrile 1-Benzoyl-2-benzyl-4-phenyl-1,2-dihydro-2-quinazolinecarbonitrile
CAS Registry Number 109271-68-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H21N3O
InChI InChI=1S/C29H21N3O/c30-21-29(20-22-12-4-1-5-13-22)31-27(23-14-6-2-7-15-23)25-18-10-11-19-26(25)32(29)28(33)24-16-8-3-9-17-24/h1-19H,20H2
InChIKey LPTXKBCGSAXSLI-UHFFFAOYSA-N
Molecular Weight 427.507 g/mol
SMILES C1(N(c2c(C(=N1)c1ccccc1)cccc2)C(=O)c1ccccc1)(C#N)Cc1ccccc1
SPLASH splash10-0a4i-0910000000-2877b47cb2cff584baf2
Source of Spectrum KC-1986-2301-11
Wiley ID 1380476