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6-Bromo-2-(3-ethoxyphenyl)-4-quinolinecarboxylic acid

View entire compound with spectra: 2 NMR

6-Bromo-2-(3-ethoxyphenyl)-4-quinolinecarboxylic acid
SpectraBase Compound ID 2iC4OXbAk9j
InChI InChI=1S/C18H14BrNO3/c1-2-23-13-5-3-4-11(8-13)17-10-15(18(21)22)14-9-12(19)6-7-16(14)20-17/h3-10H,2H2,1H3,(H,21,22)
InChIKey VNGWIIJCZIVDNZ-UHFFFAOYSA-N
Mol Weight 372.22 g/mol
Molecular Formula C18H14BrNO3
Exact Mass 371.015706 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E8QUnWWDLrO
Name 6-Bromo-2-(3-ethoxyphenyl)-4-quinolinecarboxylic acid
Comments Computed using HOSE algorithm
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Exact Mass 371.015706312 u
Formula C18H14BrNO3
InChI InChI=1S/C18H14BrNO3/c1-2-23-13-5-3-4-11(8-13)17-10-15(18(21)22)14-9-12(19)6-7-16(14)20-17/h3-10H,2H2,1H3,(H,21,22)
InChIKey VNGWIIJCZIVDNZ-UHFFFAOYSA-N
Molecular Weight 372.218 g/mol
SMILES OC(C1=C2C(=NC(=C1)C=1C=C(OCC)C=CC1)C=CC(=C2)Br)=O