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4-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)butanoic acid
SpectraBase Compound ID JozeCeO8USZ
InChI InChI=1S/C12H11BrN2O3/c13-8-3-4-10-9(6-8)12(18)15(7-14-10)5-1-2-11(16)17/h3-4,6-7H,1-2,5H2,(H,16,17)
InChIKey KLVRLAZQKHGWFR-UHFFFAOYSA-N
Mol Weight 311.14 g/mol
Molecular Formula C12H11BrN2O3
Exact Mass 309.995305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID RN7frencoz
Name 4-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)butanoic acid
CAS Registry Number 102118-21-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11BrN2O3
InChI InChI=1S/C12H11BrN2O3/c13-8-3-4-10-9(6-8)12(18)15(7-14-10)5-1-2-11(16)17/h3-4,6-7H,1-2,5H2,(H,16,17)
InChIKey KLVRLAZQKHGWFR-UHFFFAOYSA-N
Molecular Weight 311.135 g/mol
SMILES OC(CCCN1C(c2c(ccc(c2)Br)N=C1)=O)=O
SPLASH splash10-03k9-0693000000-2e3f3c236302a5f3a9d3
Source of Spectrum H-68-899-8
Synonyms 4-(6-bromo-4-keto-quinazolin-3-yl)butyric acid 4-(6-bromo-4-oxo-3-quinazolinyl)butanoic acid 4-(6-bromo-4-oxo-quinazolin-3-yl)butanoic acid
Wiley ID 1311073