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3(4H)-Quinazolinebutanoic acid, 6,8-dibromo-4-oxo-
SpectraBase Compound ID 3VqpuQBRY33
InChI InChI=1S/C12H10Br2N2O3/c13-7-4-8-11(9(14)5-7)15-6-16(12(8)19)3-1-2-10(17)18/h4-6H,1-3H2,(H,17,18)
InChIKey GTTNQINJAAYUTC-UHFFFAOYSA-N
Mol Weight 390.03 g/mol
Molecular Formula C12H10Br2N2O3
Exact Mass 387.905818 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CeT946FV1sh
Name 3(4H)-Quinazolinebutanoic acid, 6,8-dibromo-4-oxo-
CAS Registry Number 102118-22-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10Br2N2O3
InChI InChI=1S/C12H10Br2N2O3/c13-7-4-8-11(9(14)5-7)15-6-16(12(8)19)3-1-2-10(17)18/h4-6H,1-3H2,(H,17,18)
InChIKey GTTNQINJAAYUTC-UHFFFAOYSA-N
Molecular Weight 390.031 g/mol
SMILES OC(CCCN1C(c2c(N=C1)c(Br)cc(c2)Br)=O)=O
SPLASH splash10-0f7c-1039000000-2e8c2693608e0a055912
Source of Spectrum H-68-899-8
Synonyms 4-(6,8-Dibrom-4-oxo-3,4-dihydrochinazolin-3-yl)buttersaure 4-(6,8-dibromo-4-oxo-3(4H)-quinazolinyl)butanoic acid
Wiley ID 1363553