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3-(6-bromanyl-2-methyl-4-oxidanylidene-1H-quinolin-3-yl)propanoic acid
SpectraBase Compound ID 8WwCGt7o153
InChI InChI=1S/C13H12BrNO3/c1-7-9(3-5-12(16)17)13(18)10-6-8(14)2-4-11(10)15-7/h2,4,6H,3,5H2,1H3,(H,15,18)(H,16,17)
InChIKey KUELJXSOAHJEBT-UHFFFAOYSA-N
Mol Weight 310.15 g/mol
Molecular Formula C13H12BrNO3
Exact Mass 309.000056 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LiD9oOD09WG
Name 3-(6-bromanyl-2-methyl-4-oxidanylidene-1H-quinolin-3-yl)propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12BrNO3
InChI InChI=1S/C13H12BrNO3/c1-7-9(3-5-12(16)17)13(18)10-6-8(14)2-4-11(10)15-7/h2,4,6H,3,5H2,1H3,(H,15,18)(H,16,17)
InChIKey KUELJXSOAHJEBT-UHFFFAOYSA-N
Molecular Weight 310.147 g/mol
SMILES OC(CCc1c(c2c(nc1C)ccc(c2)Br)O)=O
SPLASH splash10-01ox-3491000000-0c3822378c54187775b2
Synonyms 3-(6-bromo-2-methyl-4-oxo-1H-quinolin-3-yl)propanoic acid 3-(6-Bromo-4-hydroxy-2-methyl-quinolin-3-yl)-propionic acid 3-(6-bromo-4-keto-2-methyl-1H-quinolin-3-yl)propionic acid
Wiley ID 1451039