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3-benzoyl-6-bromo-1-methyl-2-phenyl-quinolin-4-one
SpectraBase Compound ID ImyMDWBJ9i3
InChI InChI=1S/C23H16BrNO2/c1-25-19-13-12-17(24)14-18(19)23(27)20(21(25)15-8-4-2-5-9-15)22(26)16-10-6-3-7-11-16/h2-14H,1H3
InChIKey ASJCHSSRRCTGRB-UHFFFAOYSA-N
Mol Weight 418.29 g/mol
Molecular Formula C23H16BrNO2
Exact Mass 417.036442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9OgiHLpqCZx
Name 3-benzoyl-6-bromo-1-methyl-2-phenyl-quinolin-4-one
Appearance Pale yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H16BrNO2
InChI InChI=1S/C23H16BrNO2/c1-25-19-13-12-17(24)14-18(19)23(27)20(21(25)15-8-4-2-5-9-15)22(26)16-10-6-3-7-11-16/h2-14H,1H3
InChIKey ASJCHSSRRCTGRB-UHFFFAOYSA-N
Instrument Name QP2010
Ionization Type EI ion
Literature Reference DOI 10.1021/acs.jmedchem.6b01135
Molecular Weight 418.290 g/mol
SMILES c1(ccc2c(c1)C(C(=C(N2C)c1ccccc1)C(=O)c1ccccc1)=O)Br
SPLASH splash10-0a6r-9530400000-5b4708a97fd323aded4e
Source of Spectrum AF-60-1475-2t
Wiley ID 1865608