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3-Hydroxy-2-phenyl-4-(p-methoxyphenacylthio)quinazolinium bromide
SpectraBase Compound ID Kgrch84tb1H
InChI InChI=1S/C23H19N2O3S.BrH/c1-28-18-13-11-16(12-14-18)15-21(26)29-23-19-9-5-6-10-20(19)24-22(25(23)27)17-7-3-2-4-8-17;/h2-14,27H,15H2,1H3;1H/q+1;/p-1
InChIKey MLQCQRWFTYECOW-UHFFFAOYSA-M
Mol Weight 483.38 g/mol
Molecular Formula C23H19BrN2O3S
Exact Mass 482.029977 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L8UrPQOKTfV
Name 3-Hydroxy-2-phenyl-4-(p-methoxyphenacylthio)quinazolinium bromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H19BrN2O3S
InChI InChI=1S/C23H19N2O3S.BrH/c1-28-18-13-11-16(12-14-18)15-21(26)29-23-19-9-5-6-10-20(19)24-22(25(23)27)17-7-3-2-4-8-17;/h2-14,27H,15H2,1H3;1H/q+1;/p-1
InChIKey MLQCQRWFTYECOW-UHFFFAOYSA-M
Molecular Weight 483.380 g/mol
SMILES [Br-].O[n+]1c(c2ccccc2nc1-c1ccccc1)SC(=O)Cc1ccc(OC)cc1
SPLASH splash10-0f9i-6947000000-b06ff217f7e7a68fafbb
Source of Spectrum Y-20-987-0
Synonyms 3-Hydroxy-4-{[(4-methoxyphenyl)acetyl]sulfanyl}-2-phenylquinazolin-3-ium bromide
Wiley ID 1395546