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6-bromo-2-(chloromethyl)-3-(4-phenoxyphenyl)quinazolin-4(3H)-one
SpectraBase Compound ID 3W4nya0Fl7T
InChI InChI=1S/C21H14BrClN2O2/c22-14-6-11-19-18(12-14)21(26)25(20(13-23)24-19)15-7-9-17(10-8-15)27-16-4-2-1-3-5-16/h1-12H,13H2
InChIKey UTZKRFVUIXRVHE-UHFFFAOYSA-N
Mol Weight 441.71 g/mol
Molecular Formula C21H14BrClN2O2
Exact Mass 439.992718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C9HIF4sU89c
Name 6-bromo-2-(chloromethyl)-3-(4-phenoxyphenyl)quinazolin-4(3H)-one
Appearance White powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 439.992718397 u
Formula C21H14BrClN2O2
InChI InChI=1S/C21H14BrClN2O2/c22-14-6-11-19-18(12-14)21(26)25(20(13-23)24-19)15-7-9-17(10-8-15)27-16-4-2-1-3-5-16/h1-12H,13H2
InChIKey UTZKRFVUIXRVHE-UHFFFAOYSA-N
Instrument Name Agilent Technologies
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202201245
Molecular Weight 441.712 g/mol
SMILES C1(=CC2=C(C=C1)N=C(N(C2=O)C1=CC=C(C=C1)OC1=CC=CC=C1)CCl)Br
SPLASH splash10-0006-0000900000-6724569f4829ec587cfb
Source of Spectrum CBD-20-SM3-5h (DOI: 10.1002/cbdv.202201245)
Wiley ID 1909862