2-[(5-Bromo-1-methyl-2-oxo-3-indolinyl)methyl]-3-phenyl-4(3H)-quinazolinone

SpectraBase Compound ID	8J1MH22metK
InChI	InChI=1S/C24H18BrN3O2/c1-27-21-12-11-15(25)13-18(21)19(23(27)29)14-22-26-20-10-6-5-9-17(20)24(30)28(22)16-7-3-2-4-8-16/h2-13,19H,14H2,1H3
InChIKey	ZFJXQZQEKYBABM-UHFFFAOYSA-N Google Search
Mol Weight	460.33 g/mol
Molecular Formula	C24H18BrN3O2
Exact Mass	459.05824 g/mol

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SpectraBase Spectrum ID	14DvDohdfLZ
Name	2-[(5-Bromo-1-methyl-2-oxo-3-indolinyl)methyl]-3-phenyl-4(3H)-quinazolinone
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	459.058239830 u
Formula	C24H18BrN3O2
InChI	InChI=1S/C24H18BrN3O2/c1-27-21-12-11-15(25)13-18(21)19(23(27)29)14-22-26-20-10-6-5-9-17(20)24(30)28(22)16-7-3-2-4-8-16/h2-13,19H,14H2,1H3
InChIKey	ZFJXQZQEKYBABM-UHFFFAOYSA-N
Molecular Weight	460.331 g/mol
SMILES	C12=CC=CC=C2C(N(C(=N1)CC1C(N(C)C2=CC=C(C=C12)Br)=O)C1=CC=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR)	0.857107