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2-(ORTHO-BROMOPHENYL)-6-(PHENYLSULFONYL)-5,6,7,8-TETRAHYDRO-3H-QUINAZOLIN-4-ONE
SpectraBase Compound ID By5PDqtopFE
InChI InChI=1S/C20H17BrN2O3S/c21-17-9-5-4-8-15(17)19-22-18-11-10-14(12-16(18)20(24)23-19)27(25,26)13-6-2-1-3-7-13/h1-9,14H,10-12H2,(H,22,23,24)
InChIKey IJYDGZWEKDBZHX-UHFFFAOYSA-N
Mol Weight 445.33 g/mol
Molecular Formula C20H17BrN2O3S
Exact Mass 444.014327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID S5OU65Eie
Name 2-(o-Bromophenyl)-6-(phenylsulfonyl)-5,6,7,8-tetrahydro-3H-quinazolin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17BrN2O3S
InChI InChI=1S/C20H17BrN2O3S/c21-17-9-5-4-8-15(17)19-22-18-11-10-14(12-16(18)20(24)23-19)27(25,26)13-6-2-1-3-7-13/h1-9,14H,10-12H2,(H,22,23,24)
InChIKey IJYDGZWEKDBZHX-UHFFFAOYSA-N
Molecular Weight 445.331 g/mol
SMILES N1C(C2=C(N=C1c1c(cccc1)Br)CCC(C2)S(=O)(=O)c1ccccc1)=O
SPLASH splash10-0udi-2009000000-7e392d43d6432970f78c
Source of Spectrum K1-0-2759-12
Synonyms 2-(2-bromophenyl)-6-(phenylsulfonyl)-5,6,7,8-tetrahydro-4(3H)-quinazolinone 6-(benzenesulfonyl)-2-(2-bromophenyl)-5,6,7,8-tetrahydro-1H-quinazolin-4-one 2-(2-bromophenyl)-6-(phenylsulfonyl)-5,6,7,8-tetrahydro-1H-quinazolin-4-one
Wiley ID 1588976